PARP - 表观遗传学 - 按“信号通路”分类 - 小分子和化合物库

Rucaparib (AG-014699,PF-01367338),PARP抑制剂

规格或纯度 :

≥99%

CAS号 : 459868-92-9 Compound CID : 9931953

分子式: C₁₉H₁₈FN₃O·H₃PO₄ 分子量: 421.36

IUPAC Name: 6-fluoro-2-[4-(methylaminomethyl)phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;phosphoric acid

SMILES: CNCC1=CC=C(C=C1)C2=C3CCNC(=O)C4=C3C(=CC(=C4)F)N2.OP(=O)(O)O

InChIKey: FCCGJTKEKXUBFZ-UHFFFAOYSA-N

InChI: InChI=1S/C19H18FN3O.H3O4P/c1-21-10-11-2-4-12(5-3-11)18-14-6-7-22-19(24)15-8-13(20)9-16(23-18)17(14)15;1-5(2,3)4/h2-5,8-9,21,23H,6-7,10H2,1H3,(H,22,24);(H3,1,2,3,4)

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苯甲酰胺

规格或纯度 :

≥99%

CAS号 : 55-21-0 Compound CID : 2331

分子式: C₇H₇NO 分子量: 121.13

IUPAC Name: benzamide

SMILES: C1=CC=C(C=C1)C(=O)N

InChIKey: KXDAEFPNCMNJSK-UHFFFAOYSA-N

InChI: InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)

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GeA-69

规格或纯度 :

≥99%

CAS号 : 2143475-98-1 Compound CID : 135397654

分子式: C₂₀H₁₆N₂O 分子量: 300.35

IUPAC Name: N-[2-(9H-carbazol-1-yl)phenyl]acetamide

SMILES: CC(=O)NC1=CC=CC=C1C2=CC=CC3=C2NC4=CC=CC=C34

InChIKey: LDPDVNYCIOHPGF-UHFFFAOYSA-N

InChI: InChI=1S/C20H16N2O/c1-13(23)21-18-11-4-2-7-14(18)16-9-6-10-17-15-8-3-5-12-19(15)22-20(16)17/h2-12,22H,1H3,(H,21,23)

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NVP-TNKS656

规格或纯度 :

Moligand™

≥99%

CAS号 : 1419949-20-4 Compound CID : 136237316

分子式: C₂₇H₃₄N₄O₅ 分子量: 494.58

IUPAC Name: N-(cyclopropylmethyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]-N-[(4-oxo-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-yl)methyl]acetamide

SMILES: COC1=CC=C(C=C1)C(=O)C2CCN(CC2)CC(=O)N(CC3CC3)CC4=NC5=C(COCC5)C(=O)N4

InChIKey: DYGBNAYFDZEYBA-UHFFFAOYSA-N

InChI: InChI=1S/C27H34N4O5/c1-35-21-6-4-19(5-7-21)26(33)20-8-11-30(12-9-20)16-25(32)31(14-18-2-3-18)15-24-28-23-10-13-36-17-22(23)27(34)29-24/h4-7,18,20H,2-3,8-17H2,1H3,(H,28,29,34)

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尼拉帕尼(MK-4827)对苯甲磺酸盐

规格或纯度 :

≥99%

CAS号 : 1038915-73-9 Compound CID : 78357761

分子式: C₂₆H₂₈N₄O₄S 分子量: 492.59

IUPAC Name: 4-methylbenzenesulfonic acid;2-[4-[(3S)-piperidin-3-yl]phenyl]indazole-7-carboxamide

SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1CC(CNC1)C2=CC=C(C=C2)N3C=C4C=CC=C(C4=N3)C(=O)N

InChIKey: LCPFHXWLJMNKNC-PFEQFJNWSA-N

InChI: InChI=1S/C19H20N4O.C7H8O3S/c20-19(24)17-5-1-3-15-12-23(22-18(15)17)16-8-6-13(7-9-16)14-4-2-10-21-11-14;1-6-2-4-7(5-3-6)11(8,9)10/h1,3,5-9,12,14,21H,2,4,10-11H2,(H2,20,24);2-5H,1H3,(H,8,9,10)/t14-;/m1./s1

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帕米帕里布（BGB-290）

规格或纯度 :

Moligand™

≥99%

CAS号 : 1446261-44-4 Compound CID : 135565554

分子式: C₁₆H₁₅FN₄O 分子量: 298.31

IUPAC Name: (2R)-14-fluoro-2-methyl-6,9,10,19-tetrazapentacyclo[14.2.1.02,6.08,18.012,17]nonadeca-1(18),8,12(17),13,15-pentaen-11-one

SMILES: CC12CCCN1CC3=NNC(=O)C4=C5C3=C2NC5=CC(=C4)F

InChIKey: DENYZIUJOTUUNY-MRXNPFEDSA-N

InChI: InChI=1S/C16H15FN4O/c1-16-3-2-4-21(16)7-11-13-12-9(15(22)20-19-11)5-8(17)6-10(12)18-14(13)16/h5-6,18H,2-4,7H2,1H3,(H,20,22)/t16-/m1/s1

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RBN-2397

规格或纯度 :

≥99%

CAS号 : 2381037-82-5 Compound CID : 146047148

分子式: C₂₀H₂₃F₆N₇O₃ 分子量: 523.43

IUPAC Name: 4-[[(2S)-1-[3-oxo-3-[4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl]propoxy]propan-2-yl]amino]-5-(trifluoromethyl)-1H-pyridazin-6-one

SMILES: CC(COCCC(=O)N1CCN(CC1)C2=NC=C(C=N2)C(F)(F)F)NC3=C(C(=O)NN=C3)C(F)(F)F

InChIKey: UQZCQKXJAXKZQH-LBPRGKRZSA-N

InChI: InChI=1S/C20H23F6N7O3/c1-12(30-14-10-29-31-17(35)16(14)20(24,25)26)11-36-7-2-15(34)32-3-5-33(6-4-32)18-27-8-13(9-28-18)19(21,22)23/h8-10,12H,2-7,11H2,1H3,(H2,30,31,35)/t12-/m0/s1

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