General Information of the Compound
Compound ID |
CP0959369
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Compound Name |
(R)-2,3-Dimethyl-4-(3-(vinylsulfonamido)piperidin-1-yl)-1H-indole-7-carboxamide
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Structure |
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Formula |
C18H24N4O3S
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Molecular Weight |
376.482
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Canonical SMILES |
C=CS(=O)(=O)N[C@@H]1CCCN(c2ccc(C(N)=O)c3[nH]c(C)c(C)c23)C1
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InChI |
InChI=1S/C18H24N4O3S/c1-4-26(24,25)21-13-6-5-9-22(10-13)15-8-7-14(18(19)23)17-16(15)11(2)12(3)20-17/h4,7-8,13,20-21H,1,5-6,9-10H2,2-3H3,(H2,19,23)/t13-/m1/s1
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InChIKey |
QFVONLVPWAQSQW-CYBMUJFWSA-N
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Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound