General Information of the Compound
| Compound ID |
CP0177639
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| Compound Name |
US9388139, 27
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| Structure |
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| Formula |
C23H19FN2O3
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| Molecular Weight |
390.414
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| Canonical SMILES |
COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)C(O)=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C23H19FN2O3/c1-29-20-12-6-16(7-13-20)22-14-21(15-2-8-18(24)9-3-15)25-26(22)19-10-4-17(5-11-19)23(27)28/h2-13,22H,14H2,1H3,(H,27,28)
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| InChIKey |
PFQJGOZMKDZHJQ-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