General Information of the Compound
| Compound ID |
CP0414566
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| Compound Name |
US9278960, 8-1
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| Structure |
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| Formula |
C23H17ClFN3O2
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| Molecular Weight |
421.859
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| Canonical SMILES |
NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(cc2n1)[C@@H](O)Cc1ccc(Cl)nc1
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| InChI |
InChI=1S/C23H17ClFN3O2/c24-22-8-1-13(12-27-22)9-21(29)15-4-7-17-18(14-2-5-16(25)6-3-14)11-20(23(26)30)28-19(17)10-15/h1-8,10-12,21,29H,9H2,(H2,26,30)/t21-/m0/s1
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| InChIKey |
CWRYRTIWJWUWEF-NRFANRHFSA-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