General Information of the Compound
| Compound ID |
CP0492509
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| Compound Name |
US8912224, 13
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| Structure |
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| Formula |
C26H22FN3O3S
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| Molecular Weight |
475.545
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| Canonical SMILES |
CC(NC(=O)c1cnc(Oc2ccc3OC(CCc3c2)c2cccc(F)c2)s1)c1ccncc1
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| InChI |
InChI=1S/C26H22FN3O3S/c1-16(17-9-11-28-12-10-17)30-25(31)24-15-29-26(34-24)32-21-6-8-23-19(14-21)5-7-22(33-23)18-3-2-4-20(27)13-18/h2-4,6,8-16,22H,5,7H2,1H3,(H,30,31)
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| InChIKey |
SOBIFKNKVWFAHD-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