配体家族 - 小分子和化合物库

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UCN-01,PKC抑制剂
- ≥95%(HPLC)
CAS号: 112953-11-4 Compound CID : 72271

分子式: C₂₈H₂₆N₄O₄ 分子量: 482.53

IUPAC Name: (2S,3R,4R,6R,18R)-18-hydroxy-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one

SMILES: CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)C(NC6=O)O)NC)OC

InChIKey: PBCZSGKMGDDXIJ-HQCWYSJUSA-N

InChI: 1S/C28H26N4O4/c1-28-25(35-3)15(29-2)12-18(36-28)31-16-10-6-4-8-13(16)19-21-22(27(34)30-26(21)33)20-14-9-5-7-11-17(14)32(28)24(20)23(19)31/h4-11,15,18,25,27,29,34H,12H2,1-3H3,(H,30,33)/t15-,18-,25-,27-See more
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SB 218078,Chk1抑制剂
- ≥98%(HPLC)
CAS号: 135897-06-2 Compound CID : 3387354

分子式: C₂₄H₁₅N₃O₃ 分子量: 393.39

IUPAC Name: 28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaene-3,5-dione

SMILES: C1CC2N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N(C1O2)C7=C53)C(=O)NC6=O

InChIKey: OTPNDVKVEAIXTI-UHFFFAOYSA-N

InChI: 1S/C24H15N3O3/c28-23-19-17-11-5-1-3-7-13(11)26-15-9-10-16(30-15)27-14-8-4-2-6-12(14)18(22(27)21(17)26)20(19)24(29)25-23/h1-8,15-16H,9-10H2,(H,25,28,29)
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CCT244747
- 10mM in DMSO
CAS号: 1404095-34-6 Compound CID : 54758482

分子式: C₂₀H₂₄N₈O₂ 分子量: 408.47
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SCH-1473759 hydrochloride
- 10mM in DMSO
CAS号: 1094067-13-6 Compound CID : 53317913

分子式: C₂₀H₂₇ClN₈OS 分子量: 463.00
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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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SCH-1473759 hydrochloride
- ≥99%
CAS号: 1094067-13-6 Compound CID : 53317913

分子式: C₂₀H₂₇ClN₈OS 分子量: 463.00

IUPAC Name: 2-[ethyl-[[5-[[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]methyl]amino]-2-methylpropan-1-ol;hydrochloride

SMILES: CCN(CC1=NSC(=C1)NC2=NC(=CN3C2=NC=C3C4=CNN=C4)C)C(C)(C)CO.Cl

InChIKey: YBAZMWNWFHDNTH-UHFFFAOYSA-N

InChI: 1S/C20H26N8OS.ClH/c1-5-27(20(3,4)12-29)11-15-6-17(30-26-15)25-18-19-21-9-16(14-7-22-23-8-14)28(19)10-13(2)24-18;/h6-10,29H,5,11-12H2,1-4H3,(H,22,23)(H,24,25);1H
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GNE-900
CAS号: 1200126-26-6 Compound CID : 44545757

分子式: C₂₃H₂₁N₅ 分子量: 367.45

IUPAC Name: 12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile

SMILES: C1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=C(NC5=C4C=C(N=C5)C#N)N=C3

InChIKey: PPYHOOZGDDPLKM-UHFFFAOYSA-N

InChI: 1S/C23H21N5/c24-12-19-11-20-21-10-18(13-26-23(21)27-22(20)14-25-19)17-6-4-16(5-7-17)15-28-8-2-1-3-9-28/h4-7,10-11,13-14H,1-3,8-9,15H2,(H,26,27)

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CCT244747
- ≥99%
CAS号: 1404095-34-6 Compound CID : 54758482

分子式: C₂₀H₂₄N₈O₂ 分子量: 408.47

IUPAC Name: 3-[(2R)-1-(dimethylamino)propan-2-yl]oxy-5-[[4-methoxy-5-(1-methylpyrazol-4-yl)pyridin-2-yl]amino]pyrazine-2-carbonitrile

SMILES: CC(CN(C)C)OC1=NC(=CN=C1C#N)NC2=NC=C(C(=C2)OC)C3=CN(N=C3)C

InChIKey: IENLGMOXAQMNEH-CYBMUJFWSA-N

InChI: 1S/C20H24N8O2/c1-13(11-27(2)3)30-20-16(7-21)22-10-19(26-20)25-18-6-17(29-5)15(9-23-18)14-8-24-28(4)12-14/h6,8-10,12-13H,11H2,1-5H3,(H,23,25,26)/t13-/m1/s1
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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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