General Information of the Compound
| Compound ID |
CP0960805
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| Compound Name |
3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-1-fluoro-N-[1-(hydroxymethyl)cyclopropyl]cyclobutanecarboxamide
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| Structure |
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| Formula |
C23H20F4N2O2
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| Molecular Weight |
432.417
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| Canonical SMILES |
O=C(NC1(CO)CC1)C1(F)CC(c2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C1
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| InChI |
InChI=1S/C23H20F4N2O2/c24-14-3-1-12(2-4-14)19-18(16-7-15(25)8-17(26)20(16)28-19)13-9-23(27,10-13)21(31)29-22(11-30)5-6-22/h1-4,7-8,13,28,30H,5-6,9-11H2,(H,29,31)
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| InChIKey |
IPOLDMISWKAGSM-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