General Information of the Compound
| Compound ID |
CP0507778
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| Compound Name |
5-chloro-6-(4-methylpiperazin-1-yl)-N-[3-pyridin-3-yl-5-(trifluoromethoxy)phenyl]-2,3-dihydroindole-1-carboxamide
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| Structure |
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| Formula |
C26H25ClF3N5O2
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| Molecular Weight |
531.966
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| Canonical SMILES |
CN1CCN(CC1)c1cc2N(CCc2cc1Cl)C(=O)Nc1cc(OC(F)(F)F)cc(c1)-c1cccnc1
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| InChI |
InChI=1S/C26H25ClF3N5O2/c1-33-7-9-34(10-8-33)24-15-23-17(13-22(24)27)4-6-35(23)25(36)32-20-11-19(18-3-2-5-31-16-18)12-21(14-20)37-26(28,29)30/h2-3,5,11-16H,4,6-10H2,1H3,(H,32,36)
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| InChIKey |
QRIJCCNAKWXNBU-UHFFFAOYSA-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