配体家族 - 小分子和化合物库

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GSK 269962,ROCK抑制剂
- ≥98%
CAS号: 850664-21-0

分子式: C₂₉H₃₀N₈O₅ 分子量: 570.6

IUPAC Name: N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide

SMILES: CCN1C2=CC(=NC=C2N=C1C3=NON=C3N)OC4=CC=CC(=C4)NC(=O)C5=CC=C(C=C5)OCCN6CCOCC6

InChIKey: YOVNFNXUCOWYSG-UHFFFAOYSA-N

InChI: 1S/C29H30N8O5/c1-2-37-24-17-25(31-18-23(24)33-28(37)26-27(30)35-42-34-26)41-22-5-3-4-20(16-22)32-29(38)19-6-8-21(9-7-19)40-15-12-36-10-13-39-14-11-36/h3-9,16-18H,2,10-15H2,1H3,(H2,30,35)(H,32,38)
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GSK 269962
- 10mM in DMSO
CAS号: 850664-21-0

分子式: C₂₉H₃₀N₈O₅ 分子量: 570.6

IUPAC Name: N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide

SMILES: CCN1C2=CC(=NC=C2N=C1C3=NON=C3N)OC4=CC=CC(=C4)NC(=O)C5=CC=C(C=C5)OCCN6CCOCC6

InChIKey: YOVNFNXUCOWYSG-UHFFFAOYSA-N

InChI: 1S/C29H30N8O5/c1-2-37-24-17-25(31-18-23(24)33-28(37)26-27(30)35-42-34-26)41-22-5-3-4-20(16-22)32-29(38)19-6-8-21(9-7-19)40-15-12-36-10-13-39-14-11-36/h3-9,16-18H,2,10-15H2,1H3,(H2,30,35)(H,32,38)
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GDP366
- 10mM in DMSO
CAS号: 501698-03-9 Compound CID : 6539985

分子式: C₂₀H₁₇N₅OS 分子量: 375.4
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GNE-3511
- 10mM in DMSO
CAS号: 1496581-76-0 Compound CID : 72547959

分子式: C₂₃H₂₆F₂N₆O 分子量: 440.49
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Darexaban
- 10mM in DMSO
CAS号: 365462-23-3 Compound CID : 9912771

分子式: C₂₇H₃₀N₄O₄ 分子量: 474.6
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GNE-3511
- ≥99%
CAS号: 1496581-76-0 Compound CID : 72547959

分子式: C₂₃H₂₆F₂N₆O 分子量: 440.49

IUPAC Name: 2-[[6-(3,3-difluoropyrrolidin-1-yl)-4-[1-(oxetan-3-yl)piperidin-4-yl]pyridin-2-yl]amino]pyridine-4-carbonitrile

SMILES: C1CN(CCC1C2=CC(=NC(=C2)N3CCC(C3)(F)F)NC4=NC=CC(=C4)C#N)C5COC5

InChIKey: RHFIAUKMKYHHFA-UHFFFAOYSA-N

InChI: 1S/C23H26F2N6O/c24-23(25)4-8-31(15-23)22-11-18(17-2-6-30(7-3-17)19-13-32-14-19)10-21(29-22)28-20-9-16(12-26)1-5-27-20/h1,5,9-11,17,19H,2-4,6-8,13-15H2,(H,27,28,29)
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GDP366
- ≥99%
CAS号: 501698-03-9 Compound CID : 6539985

分子式: C₂₀H₁₇N₅OS 分子量: 375.4

IUPAC Name: 1-[4-(4-aminothieno[2,3-d]pyrimidin-5-yl)phenyl]-3-(3-methylphenyl)urea

SMILES: CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=CSC4=NC=NC(=C34)N

InChIKey: DZSUJUOJJJCWGG-UHFFFAOYSA-N

InChI: 1S/C20H17N5OS/c1-12-3-2-4-15(9-12)25-20(26)24-14-7-5-13(6-8-14)16-10-27-19-17(16)18(21)22-11-23-19/h2-11H,1H3,(H2,21,22,23)(H2,24,25,26)
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Darexaban
- ≥99%
CAS号: 365462-23-3 Compound CID : 9912771

分子式: C₂₇H₃₀N₄O₄ 分子量: 474.6

IUPAC Name: N-[2-hydroxy-6-[(4-methoxybenzoyl)amino]phenyl]-4-(4-methyl-1,4-diazepan-1-yl)benzamide

SMILES: CN1CCCN(CC1)C2=CC=C(C=C2)C(=O)NC3=C(C=CC=C3O)NC(=O)C4=CC=C(C=C4)OC

InChIKey: IJNIQYINMSGIPS-UHFFFAOYSA-N

InChI: 1S/C27H30N4O4/c1-30-15-4-16-31(18-17-30)21-11-7-19(8-12-21)27(34)29-25-23(5-3-6-24(25)32)28-26(33)20-9-13-22(35-2)14-10-20/h3,5-14,32H,4,15-18H2,1-2H3,(H,28,33)(H,29,34)
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