General Information of the Compound
| Compound ID |
CP0526138
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| Compound Name |
US9278960, 4-24
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| Structure |
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| Formula |
C22H21FN4O2
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| Molecular Weight |
392.434
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| Canonical SMILES |
NC(=O)[C@@H]1CCCN1Cc1ccc2c(cc(nc2c1)C(N)=O)-c1ccc(F)cc1
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| InChI |
InChI=1S/C22H21FN4O2/c23-15-6-4-14(5-7-15)17-11-19(21(24)28)26-18-10-13(3-8-16(17)18)12-27-9-1-2-20(27)22(25)29/h3-8,10-11,20H,1-2,9,12H2,(H2,24,28)(H2,25,29)/t20-/m0/s1
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| InChIKey |
YRSQMMADIJTLEO-FQEVSTJZSA-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