General Information of the Compound
| Compound ID |
CP0871863
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| Compound Name |
(4-Fluoro-1-methyl-5,6,7,8,9,10-hexahydro-7,10-epiminocyclohepta[b]indol-11-yl)(5-(trifluoromethyl)-1H-pyrazol-3-yl)methanone
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| Formula |
C19H16F4N4O
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| Molecular Weight |
392.356
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| Canonical SMILES |
Cc1ccc(F)c2[nH]c3c(c12)[C@@H]1CC[C@H](C3)N1C(=O)c1cc(C(F)(F)F)[nH]n1
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| InChI |
InChI=1S/C19H16F4N4O/c1-8-2-4-10(20)17-15(8)16-11(24-17)6-9-3-5-13(16)27(9)18(28)12-7-14(26-25-12)19(21,22)23/h2,4,7,9,13,24H,3,5-6H2,1H3,(H,25,26)/t9-,13+/m1/s1
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| InChIKey |
OSLMEEPZFKJSCW-RNCFNFMXSA-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