General Information of the Compound
| Compound ID |
CP0710220
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| Compound Name |
(Z)-3-{[4-(N-Acetyl-dimethylcarbamoylmethyl-amino)-phenylamino]-phenyl-methylene}-2-oxo-2,3-dihydro-1H-indole-6-carboxylic acid Methyl Ester
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| Formula |
C29H28N4O5
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| Molecular Weight |
512.566
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| Canonical SMILES |
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(N(CC(=O)N(C)C)C(C)=O)cc1)c1ccccc1
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| InChI |
InChI=1S/C29H28N4O5/c1-18(34)33(17-25(35)32(2)3)22-13-11-21(12-14-22)30-27(19-8-6-5-7-9-19)26-23-15-10-20(29(37)38-4)16-24(23)31-28(26)36/h5-16,30H,17H2,1-4H3,(H,31,36)/b27-26-
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| InChIKey |
PKXSPUDURLLHHG-RQZHXJHFSA-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