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    N N N N N N N N N H O F F H 3 C
    84S
    Name:N-(6-{difluoro[6-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}imidazo[1,2-b]pyridazin-2-yl)cyclopropanecarboxamide
    Formula:C21 H17 F2 N9 O
    SMILES:c1(cnn(C)c1)c6cn5c(nnc5C(c4ccc2n(cc(n2)NC(=O)C3CC3)n4)(F)F)cc6
    InChi:InChI=1S/C21H17F2N9O/c1-30-9-14(8-24-30)13-4-6-18-27-28-20(31(18)10-13)21(22,23)15-5-7-17-25-16(11-32(17)29-15)26-19(33)12-2-3-12/h4-12H,2-3H2,1H3,(H,26,33)
    Definition date:2016-12-24
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:N-(6-{difluoro[6-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}imidazo[1,2-b]pyridazin-2-yl)cyclopropanecarboxamide
    H 3 C H 3 C O O O CH 3
    A0O
    Name:7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one
    Formula:C15 H16 O3
    SMILES:COc1ccc2C=CC(=O)Oc2c1CC=C(C)C
    InChi:InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3
    Definition date:2018-09-12
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one
    O N N N NH 2 H 3 C
    BV9
    Name:4-[5-(1-methylpyrazol-4-yl)pyridin-3-yl]benzamide
    Formula:C16 H14 N4 O
    SMILES:Cn1cc(cn1)c2cncc(c2)c3ccc(cc3)C(N)=O
    InChi:InChI=1S/C16H14N4O/c1-20-10-15(9-19-20)14-6-13(7-18-8-14)11-2-4-12(5-3-11)16(17)21/h2-10H,1H3,(H2,17,21)
    Definition date:2019-03-13
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:4-[5-(1-methylpyrazol-4-yl)pyridin-3-yl]benzamide
    N H N N H N N O HN H 2 N O S O NH O CH 3 O H 3 C N
    CKL
    Name:4-[(2-azanyl-4-oxidanylidene-7,8-dihydro-3~{H}-pteridin-6-yl)methylamino]-~{N}-(5,6-dimethoxypyrimidin-4-yl)benzenesulfonamide
    Formula:C19 H21 N9 O5 S
    SMILES:COc1ncnc(N[S](=O)(=O)c2ccc(NCC3=NC4=C(NC3)N=C(N)NC4=O)cc2)c1OC
    InChi:InChI=1S/C19H21N9O5S/c1-32-14-16(23-9-24-18(14)33-2)28-34(30,31)12-5-3-10(4-6-12)21-7-11-8-22-15-13(25-11)17(29)27-19(20)26-15/h3-6,9,21H,7-8H2,1-2H3,(H,23,24,28)(H4,20,22,26,27,29)
    Definition date:2019-04-25
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:4-[(2-azanyl-4-oxidanylidene-7,8-dihydro-3~{H}-pteridin-6-yl)methylamino]-~{N}-(5,6-dimethoxypyrimidin-4-yl)benzenesulfonamide
    O F F F HO O O S CH 3 N N H CH 3
    E6R
    Name:1-(2-hydroxyethyl)-4-methyl-N-(4-methylsulfonylphenyl)-5-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxamide
    Formula:C22 H21 F3 N2 O4 S
    SMILES:Cc1c(cn(CCO)c1c2ccccc2C(F)(F)F)C(=O)Nc3ccc(cc3)[S](C)(=O)=O
    InChi:InChI=1S/C22H21F3N2O4S/c1-14-18(21(29)26-15-7-9-16(10-8-15)32(2,30)31)13-27(11-12-28)20(14)17-5-3-4-6-19(17)22(23,24)25/h3-10,13,28H,11-12H2,1-2H3,(H,26,29)
    Synonyms:esaxerenone
    Definition date:2019-11-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:1-(2-hydroxyethyl)-4-methyl-~{N}-(4-methylsulfonylphenyl)-5-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxamide
    O O CH 3 N H O O OH O H 3 C O
    EB6
    Name:methyl (2~{S})-3-[4-[3-(4-methoxy-2-oxidanyl-phenyl)prop-2-ynoyloxy]phenyl]-2-[[2-(phenylcarbonyl)phenyl]amino]propanoate
    Formula:C33 H27 N O7
    SMILES:COC(=O)[CH](Cc1ccc(OC(=O)C#Cc2ccc(OC)cc2O)cc1)Nc3ccccc3C(=O)c4ccccc4
    InChi:InChI=1S/C33H27NO7/c1-39-26-18-14-23(30(35)21-26)15-19-31(36)41-25-16-12-22(13-17-25)20-29(33(38)40-2)34-28-11-7-6-10-27(28)32(37)24-8-4-3-5-9-24/h3-14,16-18,21,29,34-35H,20H2,1-2H3/t29-/m0/s1
    Definition date:2019-12-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:methyl (2~{S})-3-[4-[3-(4-methoxy-2-oxidanyl-phenyl)prop-2-ynoyloxy]phenyl]-2-[[2-(phenylcarbonyl)phenyl]amino]propanoate
    O O O CH 3
    EBF
    Name:7-methoxychromen-2-one
    Formula:C10 H8 O3
    SMILES:COc1ccc2C=CC(=O)Oc2c1
    InChi:InChI=1S/C10H8O3/c1-12-8-4-2-7-3-5-10(11)13-9(7)6-8/h2-6H,1H3
    Definition date:2019-12-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:7-methoxychromen-2-one
    HO O O CH 3
    EJL
    Name:(9Z,12Z,15Z,18Z,21Z)-5-oxidanylidenetetracosa-9,12,15,18,21-pentaen-6-ynoic acid
    Formula:C24 H32 O3
    SMILES:CCC=CCC=CCC=CCC=CCC=CCC#CC(=O)CCCC(O)=O
    InChi:InChI=1S/C24H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(25)21-19-22-24(26)27/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17,19,21-22H2,1H3,(H,26,27)/b4-3-,7-6-,10-9-,13-12-,16-15-
    Definition date:2020-01-08
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:(9~{Z},12~{Z},15~{Z},18~{Z},21~{Z})-5-oxidanylidenetetracosa-9,12,15,18,21-pentaen-6-ynoic acid
    O O N CH 3 H 3 C
    EJO
    Name:7-(diethylamino)chromen-2-one
    Formula:C13 H15 N O2
    SMILES:CCN(CC)c1ccc2C=CC(=O)Oc2c1
    InChi:InChI=1S/C13H15NO2/c1-3-14(4-2)11-7-5-10-6-8-13(15)16-12(10)9-11/h5-9H,3-4H2,1-2H3
    Definition date:2020-01-08
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:7-(diethylamino)chromen-2-one
    F F HO HO O N H N H CH 3 CH 3 O
    J4B
    Name:~{N}'-[(2~{S})-2-[3,5-bis(fluoranyl)phenyl]-2-oxidanyl-ethanoyl]-2-ethyl-3-methyl-4-oxidanyl-benzohydrazide
    Formula:C18 H18 F2 N2 O4
    SMILES:CCc1c(C)c(O)ccc1C(=O)NNC(=O)[CH](O)c2cc(F)cc(F)c2
    InChi:InChI=1S/C18H18F2N2O4/c1-3-13-9(2)15(23)5-4-14(13)17(25)21-22-18(26)16(24)10-6-11(19)8-12(20)7-10/h4-8,16,23-24H,3H2,1-2H3,(H,21,25)(H,22,26)/t16-/m0/s1
    Definition date:2019-01-23
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:~{N}'-[(2~{S})-2-[3,5-bis(fluoranyl)phenyl]-2-oxidanyl-ethanoyl]-2-ethyl-3-methyl-4-oxidanyl-benzohydrazide
    N N N HO OH N CH 3 CH 3 CH 3 H 3 C OH O O O OH P N HN O O
    J4T
    Name:[(2~{R},3~{S},4~{R},5~{R})-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-4-[1-[(2,2,5,5-tetramethyl-1-oxidanyl-pyrrol-3-yl)methyl]-1,2,3-triazol-4-yl]oxolan-2-yl]methyl dihydrogen phosphate
    Formula:C20 H29 N6 O9 P
    SMILES:CC1(C)C=C(Cn2cc(nn2)[CH]3[CH](O)[CH](CO[P](O)(O)=O)O[CH]3N4C=CC(=O)NC4=O)C(C)(C)N1O
    InChi:InChI=1S/C20H29N6O9P/c1-19(2)7-11(20(3,4)26(19)30)8-24-9-12(22-23-24)15-16(28)13(10-34-36(31,32)33)35-17(15)25-6-5-14(27)21-18(25)29/h5-7,9,13,15-17,28,30H,8,10H2,1-4H3,(H,21,27,29)(H2,31,32,33)/t13-,15-,16-,17-/m1/s1
    Definition date:2019-01-25
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:[(2~{R},3~{S},4~{R},5~{R})-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-4-[1-[(2,2,5,5-tetramethyl-1-oxidanyl-pyrrol-3-yl)methyl]-1,2,3-triazol-4-yl]oxolan-2-yl]methyl dihydrogen phosphate
    NH N H 2 N Br
    J58
    Name:3-bromanyl-2~{H}-indazol-5-amine
    Formula:C7 H6 Br N3
    SMILES:Nc1ccc2n[nH]c(Br)c2c1
    InChi:InChI=1S/C7H6BrN3/c8-7-5-3-4(9)1-2-6(5)10-11-7/h1-3H,9H2,(H,10,11)
    Definition date:2019-01-25
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:3-bromanyl-2~{H}-indazol-5-amine
    OH O O OH
    L4M
    Name:4-{[(1S,2S)-2-(carboxymethyl)cyclopentyl]methyl}benzoic acid
    Formula:C15 H18 O4
    SMILES:C1(CCCC1CC(O)=O)Cc2ccc(cc2)C(O)=O
    InChi:InChI=1S/C15H18O4/c16-14(17)9-13-3-1-2-12(13)8-10-4-6-11(7-5-10)15(18)19/h4-7,12-13H,1-3,8-9H2,(H,16,17)(H,18,19)/t12-,13-/m0/s1
    Definition date:2019-02-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:4-{[(1S,2S)-2-(carboxymethyl)cyclopentyl]methyl}benzoic acid
    N N N N N H NH 2 N HO HO O O O O
    L4S
    Name:2',5'-dideoxy-5'-[4-({[(1S,2R)-2-(2-hydroxybenzene-1-carbonyl)cyclopentyl]acetyl}amino)-1H-1,2,3-triazol-1-yl]cytidine
    Formula:C25 H29 N7 O6
    SMILES:C(=O)(Nc3nnn(CC2C(CC(N1C=CC(N)=NC1=O)O2)O)c3)CC5CCCC5C(c4ccccc4O)=O
    InChi:InChI=1S/C25H29N7O6/c26-20-8-9-32(25(37)27-20)23-11-18(34)19(38-23)12-31-13-21(29-30-31)28-22(35)10-14-4-3-6-15(14)24(36)16-5-1-2-7-17(16)33/h1-2,5,7-9,13-15,18-19,23,33-34H,3-4,6,10-12H2,(H,28,35)(H2,26,27,37)/t14-,15+,18-,19+,23+/m0/s1
    Definition date:2019-02-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:2',5'-dideoxy-5'-[4-({[(1S,2R)-2-(2-hydroxybenzene-1-carbonyl)cyclopentyl]acetyl}amino)-1H-1,2,3-triazol-1-yl]cytidine
    OH O O HO
    L5A
    Name:(4-{[(1S,2S)-2-(carboxymethyl)cyclopentyl]methyl}phenyl)acetic acid
    Formula:C16 H20 O4
    SMILES:C1(C(CC(O)=O)CCC1)Cc2ccc(cc2)CC(O)=O
    InChi:InChI=1S/C16H20O4/c17-15(18)9-12-6-4-11(5-7-12)8-13-2-1-3-14(13)10-16(19)20/h4-7,13-14H,1-3,8-10H2,(H,17,18)(H,19,20)/t13-,14-/m0/s1
    Definition date:2019-02-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:(4-{[(1S,2S)-2-(carboxymethyl)cyclopentyl]methyl}phenyl)acetic acid
    O HO HO O
    L5J
    Name:(4-{[(1R,2R)-2-(carboxymethyl)cyclopentyl]methyl}phenyl)acetic acid
    Formula:C16 H20 O4
    SMILES:C1(C(CC(O)=O)CCC1)Cc2ccc(cc2)CC(O)=O
    InChi:InChI=1S/C16H20O4/c17-15(18)9-12-6-4-11(5-7-12)8-13-2-1-3-14(13)10-16(19)20/h4-7,13-14H,1-3,8-10H2,(H,17,18)(H,19,20)/t13-,14-/m1/s1
    Definition date:2019-02-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:(4-{[(1R,2R)-2-(carboxymethyl)cyclopentyl]methyl}phenyl)acetic acid
    HO O OH O O
    L67
    Name:{(1S,2R)-2-[4-(carboxymethyl)benzene-1-carbonyl]cyclopentyl}acetic acid
    Formula:C16 H18 O5
    SMILES:C2C(C(c1ccc(cc1)CC(=O)O)=O)C(CC2)CC(=O)O
    InChi:InChI=1S/C16H18O5/c17-14(18)8-10-4-6-11(7-5-10)16(21)13-3-1-2-12(13)9-15(19)20/h4-7,12-13H,1-3,8-9H2,(H,17,18)(H,19,20)
    Definition date:2019-02-06
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:{(1S,2R)-2-[4-(carboxymethyl)benzene-1-carbonyl]cyclopentyl}acetic acid
    OH O OH O O O H 3 C
    L6J
    Name:[(1R,2R)-2-(2-methoxybenzene-1-carbonyl)cyclopentyl]propanedioic acid
    Formula:C16 H18 O6
    SMILES:C2(C(c1c(cccc1)OC)=O)CCCC2C(C(=O)O)C(=O)O
    InChi:InChI=1S/C16H18O6/c1-22-12-8-3-2-5-11(12)14(17)10-7-4-6-9(10)13(15(18)19)16(20)21/h2-3,5,8-10,13H,4,6-7H2,1H3,(H,18,19)(H,20,21)/t9?,10-/m1/s1
    Definition date:2019-02-07
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:[(1R,2R)-2-(2-methoxybenzene-1-carbonyl)cyclopentyl]propanedioic acid
    NH 2 NH N H N N O O HO O OH O O O O HO
    L6M
    Name:5'-{[N-({(1S,2R)-2-[4-(carboxymethyl)benzene-1-carbonyl]cyclopentyl}acetyl)-L-gamma-glutamyl]amino}-2',5'-dideoxycytidine
    Formula:C30 H37 N5 O10
    SMILES:C(CC(C(=O)O)NC(CC2C(C(c1ccc(CC(=O)O)cc1)=O)CCC2)=O)C(NCC4C(CC(N3C=CC(=NC3=O)N)O4)O)=O
    InChi:InChI=1S/C30H37N5O10/c31-23-10-11-35(30(44)34-23)26-14-21(36)22(45-26)15-32-24(37)9-8-20(29(42)43)33-25(38)13-18-2-1-3-19(18)28(41)17-6-4-16(5-7-17)12-27(39)40/h4-7,10-11,18-22,26,36H,1-3,8-9,12-15H2,(H,32,37)(H,33,38)(H,39,40)(H,42,43)(H2,31,34,44)/t18-,19+,20-,21-,22+,26+/m0/s1
    Definition date:2019-02-07
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:5'-{[N-({(1S,2R)-2-[4-(carboxymethyl)benzene-1-carbonyl]cyclopentyl}acetyl)-L-gamma-glutamyl]amino}-2',5'-dideoxycytidine
    S S O O O N H N
    L6V
    Name:N-{[(4-cyanophenyl)methyl]sulfonyl}-1-(thiophen-3-yl)cyclohexane-1-carboxamide
    Formula:C19 H20 N2 O3 S2
    SMILES:c1cc(ccc1CS(NC(C2(CCCCC2)c3ccsc3)=O)(=O)=O)C#N
    InChi:InChI=1S/C19H20N2O3S2/c20-12-15-4-6-16(7-5-15)14-26(23,24)21-18(22)19(9-2-1-3-10-19)17-8-11-25-13-17/h4-8,11,13H,1-3,9-10,14H2,(H,21,22)
    Definition date:2019-02-07
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:N-{[(4-cyanophenyl)methyl]sulfonyl}-1-(thiophen-3-yl)cyclohexane-1-carboxamide
    F F F F O O S HO F F F
    L7D
    Name:1,1,1,3,3,3-hexafluoro-2-(4-{1-[(4-fluorophenyl)sulfonyl]cyclopentyl}phenyl)propan-2-ol
    Formula:C20 H17 F7 O3 S
    SMILES:c3c(ccc(S(C1(CCCC1)c2ccc(cc2)C(O)(C(F)(F)F)C(F)(F)F)(=O)=O)c3)F
    InChi:InChI=1S/C20H17F7O3S/c21-15-7-9-16(10-8-15)31(29,30)17(11-1-2-12-17)13-3-5-14(6-4-13)18(28,19(22,23)24)20(25,26)27/h3-10,28H,1-2,11-12H2
    Definition date:2019-02-08
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:1,1,1,3,3,3-hexafluoro-2-(4-{1-[(4-fluorophenyl)sulfonyl]cyclopentyl}phenyl)propan-2-ol
    N H H 3 C CH 3 H 3 C N N H O O O O O O O S
    LL7
    Name:(2~{S})-~{N}-[3-oxidanylidene-3-[(3,4,5-trimethoxyphenyl)amino]propyl]-1-(phenylmethyl)sulfonyl-piperidine-2-carboxamide
    Formula:C25 H33 N3 O7 S
    SMILES:COc1cc(NC(=O)CCNC(=O)[CH]2CCCCN2[S](=O)(=O)Cc3ccccc3)cc(OC)c1OC
    InChi:InChI=1S/C25H33N3O7S/c1-33-21-15-19(16-22(34-2)24(21)35-3)27-23(29)12-13-26-25(30)20-11-7-8-14-28(20)36(31,32)17-18-9-5-4-6-10-18/h4-6,9-10,15-16,20H,7-8,11-14,17H2,1-3H3,(H,26,30)(H,27,29)/t20-/m0/s1
    Definition date:2019-03-01
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:(2~{S})-~{N}-[3-oxidanylidene-3-[(3,4,5-trimethoxyphenyl)amino]propyl]-1-(phenylmethyl)sulfonyl-piperidine-2-carboxamide
    S O O O O O N N H N
    LLD
    Name:2-(pyridin-3-ylcarbonylamino)ethyl (2~{S})-1-(phenylmethyl)sulfonylpiperidine-2-carboxylate
    Formula:C21 H25 N3 O5 S
    SMILES:O=C(NCCOC(=O)[CH]1CCCCN1[S](=O)(=O)Cc2ccccc2)c3cccnc3
    InChi:InChI=1S/C21H25N3O5S/c25-20(18-9-6-11-22-15-18)23-12-14-29-21(26)19-10-4-5-13-24(19)30(27,28)16-17-7-2-1-3-8-17/h1-3,6-9,11,15,19H,4-5,10,12-14,16H2,(H,23,25)/t19-/m0/s1
    Definition date:2019-03-01
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:2-(pyridin-3-ylcarbonylamino)ethyl (2~{S})-1-(phenylmethyl)sulfonylpiperidine-2-carboxylate
    H 2 N N N NH 2 N N
    MV4
    Name:7-[(3R)-3-aminopyrrolidin-1-yl]-6-(naphthalen-1-yl)pyrido[2,3-d]pyrimidin-2-amine
    Formula:C21 H20 N6
    SMILES:c13nc(ncc1cc(c(N2CCC(N)C2)n3)c5c4ccccc4ccc5)N
    InChi:InChI=1S/C21H20N6/c22-15-8-9-27(12-15)20-18(10-14-11-24-21(23)26-19(14)25-20)17-7-3-5-13-4-1-2-6-16(13)17/h1-7,10-11,15H,8-9,12,22H2,(H2,23,24,25,26)/t15-/m1/s1
    Definition date:2019-04-17
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:7-[(3R)-3-aminopyrrolidin-1-yl]-6-(naphthalen-1-yl)pyrido[2,3-d]pyrimidin-2-amine
    OH NH O N
    MXQ
    Name:(1~{R},9~{S})-5-(3-oxidanylpropyl)-7,11-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4-dien-6-one
    Formula:C14 H20 N2 O2
    SMILES:OCCCC1=CC=C2[CH]3CNC[CH](C3)CN2C1=O
    InChi:InChI=1S/C14H20N2O2/c17-5-1-2-11-3-4-13-12-6-10(7-15-8-12)9-16(13)14(11)18/h3-4,10,12,15,17H,1-2,5-9H2/t10-,12+/m0/s1
    Definition date:2019-10-29
    Last modified:2020-02-07
    Release date:2020-02-12
    Identifier:(1~{R},9~{S})-5-(3-oxidanylpropyl)-7,11-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4-dien-6-one