General Information of the Compound
| Compound ID |
CP0499164
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| Compound Name |
5-[(4S,5S)-4-(4-Fluorophenyl)-4-(6-fluoropyridin-3-yl)-5-methyl-4,5-dihydro-1H-imidazol-2-yl]-1-(propan-2-yl)pyridin-2(1H)-one
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| Structure |
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| Formula |
C23H22F2N4O
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| Molecular Weight |
408.452
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| Canonical SMILES |
CC(C)n1cc(ccc1=O)C1=N[C@@]([C@H](C)N1)(c1ccc(F)cc1)c1ccc(F)nc1
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| InChI |
InChI=1S/C23H22F2N4O/c1-14(2)29-13-16(4-11-21(29)30)22-27-15(3)23(28-22,17-5-8-19(24)9-6-17)18-7-10-20(25)26-12-18/h4-15H,1-3H3,(H,27,28)/t15-,23-/m0/s1
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| InChIKey |
HSDSMAIMLPGKQY-WNSKOXEYSA-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