General Information of the Compound
| Compound ID |
CP0487537
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| Compound Name |
N-(4-fluorophenyl)-N-[[4-[5-fluoro-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-3-methylbutanamide
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| Formula |
C25H23F2N5O
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| Molecular Weight |
447.489
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| Canonical SMILES |
CC(C)CC(=O)N(Cc1ccc(cc1)-c1cc(F)ccc1-c1nnn[nH]1)c1ccc(F)cc1
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| InChI |
InChI=1S/C25H23F2N5O/c1-16(2)13-24(33)32(21-10-7-19(26)8-11-21)15-17-3-5-18(6-4-17)23-14-20(27)9-12-22(23)25-28-30-31-29-25/h3-12,14,16H,13,15H2,1-2H3,(H,28,29,30,31)
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| InChIKey |
RQUHXGSBGPEBHW-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