General Information of the Compound
| Compound ID |
CP0384065
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| Compound Name |
US9394293, G215a
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| Structure |
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| Formula |
C24H22FN3O3S
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| Molecular Weight |
451.523
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| Canonical SMILES |
Cc1cc2nc(NC(=O)c3ccc(cc3)-c3ncc(C[C@@H](O)CO)cc3F)sc2cc1C
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| InChI |
InChI=1S/C24H22FN3O3S/c1-13-7-20-21(8-14(13)2)32-24(27-20)28-23(31)17-5-3-16(4-6-17)22-19(25)10-15(11-26-22)9-18(30)12-29/h3-8,10-11,18,29-30H,9,12H2,1-2H3,(H,27,28,31)/t18-/m1/s1
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| InChIKey |
SQKJDMWPYXHXHU-GOSISDBHSA-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