General Information of the Compound
| Compound ID |
CP0690546
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| Compound Name |
(Z)-3-(phenyl(4-(piperidin-1-ylmethyl)phenylamino)methylene)-6-(pyrrolidine-2-carbonyl)indolin-2-one
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| Formula |
C32H34N4O2
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| Molecular Weight |
506.65
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| Canonical SMILES |
O=C1Nc2cc(C(=O)C3CCCN3)ccc2/C1=C(/Nc1ccc(CN2CCCCC2)cc1)c1ccccc1
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| InChI |
InChI=1S/C32H34N4O2/c37-31(27-10-7-17-33-27)24-13-16-26-28(20-24)35-32(38)29(26)30(23-8-3-1-4-9-23)34-25-14-11-22(12-15-25)21-36-18-5-2-6-19-36/h1,3-4,8-9,11-16,20,27,33-34H,2,5-7,10,17-19,21H2,(H,35,38)/b30-29-
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| InChIKey |
MBBLYOALTCWBEV-FLWNBWAVSA-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