General Information of the Compound
| Compound ID |
CP0577585
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| Compound Name |
(E)-3-[4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2,3-dihydroindol-1-yl]methyl]phenyl]-N-hydroxyprop-2-enamide
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| Structure |
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| Formula |
C26H22ClF3N4O3
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| Molecular Weight |
530.934
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| Canonical SMILES |
ONC(=O)\C=C\c1ccc(CN2CCc3cc(NC(=O)Nc4ccc(Cl)c(c4)C(F)(F)F)ccc23)cc1
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| InChI |
InChI=1S/C26H22ClF3N4O3/c27-22-8-6-20(14-21(22)26(28,29)30)32-25(36)31-19-7-9-23-18(13-19)11-12-34(23)15-17-3-1-16(2-4-17)5-10-24(35)33-37/h1-10,13-14,37H,11-12,15H2,(H,33,35)(H2,31,32,36)/b10-5+
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| InChIKey |
GVMARDIUMZOEHX-BJMVGYQFSA-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