General Information of the Compound
| Compound ID |
CP0915822
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| Compound Name |
(Z)-2-oxo-3-[Phenyl-(4-piperidin-1-ylmethyl-phenylamino)-methylene]-2,3-dihydro-1H-indole-6-carboxylic Acid Ethyl Ester
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| Formula |
C30H31N3O3
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| Molecular Weight |
481.596
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| Canonical SMILES |
CCOC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(CN2CCCCC2)cc1)c1ccccc1
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| InChI |
InChI=1S/C30H31N3O3/c1-2-36-30(35)23-13-16-25-26(19-23)32-29(34)27(25)28(22-9-5-3-6-10-22)31-24-14-11-21(12-15-24)20-33-17-7-4-8-18-33/h3,5-6,9-16,19,31H,2,4,7-8,17-18,20H2,1H3,(H,32,34)/b28-27-
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| InChIKey |
SRSFGSQMDZJKHV-DQSJHHFOSA-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