General Information of the Compound
| Compound ID |
CP0444546
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| Compound Name |
CHEMBL4866146
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| Formula |
C23H26FN3O2
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| Molecular Weight |
395.478
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| Canonical SMILES |
CC(C)(O)[C@H]1CC[C@@H](CC1)NC(=O)c1ccc2n(ncc2c1)-c1cccc(F)c1
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| InChI |
InChI=1S/C23H26FN3O2/c1-23(2,29)17-7-9-19(10-8-17)26-22(28)15-6-11-21-16(12-15)14-25-27(21)20-5-3-4-18(24)13-20/h3-6,11-14,17,19,29H,7-10H2,1-2H3,(H,26,28)/t17-,19-
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| InChIKey |
AWJZSXZTZBLZIA-UAPYVXQJSA-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