General Information of the Compound
| Compound ID |
CP0915677
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| Compound Name |
US9120797, 35
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| Structure |
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| Formula |
C25H29FN2O
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| Molecular Weight |
392.518
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| Canonical SMILES |
CC1Cc2c([nH]c3ccc(F)cc23)C2(CCC(c3ccccc3)(N(C)C)CC2)O1
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| InChI |
InChI=1S/C25H29FN2O/c1-17-15-21-20-16-19(26)9-10-22(20)27-23(21)25(29-17)13-11-24(12-14-25,28(2)3)18-7-5-4-6-8-18/h4-10,16-17,27H,11-15H2,1-3H3
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| InChIKey |
PFZLXGIYSYVVJF-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