General Information of the Compound
| Compound ID |
CP0563551
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| Compound Name |
1-cyclopentyl-5-(2,6-dimethoxyphenyl)-N-[(3S)-1-[2-methoxyethyl(methyl)amino]-1-oxo-5-piperidin-1-ylpentan-3-yl]pyrazole-3-carboxamide
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| Structure |
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| Formula |
C31H47N5O5
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| Molecular Weight |
569.747
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| Canonical SMILES |
COCCN(C)C(=O)C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(n1)C1CCCC1
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| InChI |
InChI=1S/C31H47N5O5/c1-34(19-20-39-2)29(37)21-23(15-18-35-16-8-5-9-17-35)32-31(38)25-22-26(36(33-25)24-11-6-7-12-24)30-27(40-3)13-10-14-28(30)41-4/h10,13-14,22-24H,5-9,11-12,15-21H2,1-4H3,(H,32,38)/t23-/m0/s1
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| InChIKey |
YSPVNMSTOKLCOU-QHCPKHFHSA-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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Map of Molecular Bioactivity Related to the Compound
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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