General Information of the Compound
| Compound ID |
CP0784802
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| Compound Name |
(Z)-N-(2-hydroxyethyl)-2-oxo-3-(phenyl(4-(piperidin-1-ylmethyl)phenylamino)methylene)indoline-6-carboxamide
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| Formula |
C30H32N4O3
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| Molecular Weight |
496.611
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| Canonical SMILES |
O=C1Nc2cc(C(=O)NCCO)ccc2/C1=C(/Nc1ccc(CN2CCCCC2)cc1)c1ccccc1
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| InChI |
InChI=1S/C30H32N4O3/c35-18-15-31-29(36)23-11-14-25-26(19-23)33-30(37)27(25)28(22-7-3-1-4-8-22)32-24-12-9-21(10-13-24)20-34-16-5-2-6-17-34/h1,3-4,7-14,19,32,35H,2,5-6,15-18,20H2,(H,31,36)(H,33,37)/b28-27-
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| InChIKey |
GHVSDYKIMLGPGX-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