General Information of the Compound
| Compound ID |
CP0648235
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| Compound Name |
(Z)-2-oxo-3-{[4-(2-oxo-Pyrrolidin-1-ylmethyl)-phenylamino]-phenylmethylene}-2,3-dihydro-1H-indole-6-carboxylic Acid Methyl Ester
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| Formula |
C28H25N3O4
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| Molecular Weight |
467.525
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| Canonical SMILES |
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(CN2CCCC2=O)cc1)c1ccccc1
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| InChI |
InChI=1S/C28H25N3O4/c1-35-28(34)20-11-14-22-23(16-20)30-27(33)25(22)26(19-6-3-2-4-7-19)29-21-12-9-18(10-13-21)17-31-15-5-8-24(31)32/h2-4,6-7,9-14,16,29H,5,8,15,17H2,1H3,(H,30,33)/b26-25-
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| InChIKey |
GOKDKIASNQUVBS-QPLCGJKRSA-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