General Information of the Compound
| Compound ID |
CP0970393
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| Compound Name |
cis-3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-(2-pyrrol-1-ylethyl)cyclobutanecarboxamide
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| Formula |
C25H22F3N3O
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| Molecular Weight |
437.465
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| Canonical SMILES |
O=C(NCCn1cccc1)[C@H]1C[C@@H](c2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc32)C1
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| InChI |
InChI=1S/C25H22F3N3O/c26-18-5-3-15(4-6-18)23-22(20-13-19(27)14-21(28)24(20)30-23)16-11-17(12-16)25(32)29-7-10-31-8-1-2-9-31/h1-6,8-9,13-14,16-17,30H,7,10-12H2,(H,29,32)/t16-,17+
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| InChIKey |
OUXFKNRAWCUZTK-CALCHBBNSA-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