General Information of the Compound
| Compound ID |
CP0501957
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| Compound Name |
(S)-N-(3,5-bis(trifluoromethyl)benzyl)-2-(4-fluorophenyl)-4-(piperidin-1-yl)butanamide
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| Structure |
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| Formula |
C24H25F7N2O
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| Molecular Weight |
490.463
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| Canonical SMILES |
Fc1ccc(cc1)[C@H](CCN1CCCCC1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C24H25F7N2O/c25-20-6-4-17(5-7-20)21(8-11-33-9-2-1-3-10-33)22(34)32-15-16-12-18(23(26,27)28)14-19(13-16)24(29,30)31/h4-7,12-14,21H,1-3,8-11,15H2,(H,32,34)/t21-/m0/s1
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| InChIKey |
CZLVMWKYTYQCCO-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