General Information of the Compound
| Compound ID |
CP0496763
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| Compound Name |
(S)-N-(3,5-bis(trifluoromethyl)benzyl)-2-((3-(dimethylamino)propyl)(methyl)amino)-2-phenylacetamide
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| Structure |
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| Formula |
C23H27F6N3O
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| Molecular Weight |
475.477
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| Canonical SMILES |
CN(C)CCCN(C)[C@H](C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccccc1
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| InChI |
InChI=1S/C23H27F6N3O/c1-31(2)10-7-11-32(3)20(17-8-5-4-6-9-17)21(33)30-15-16-12-18(22(24,25)26)14-19(13-16)23(27,28)29/h4-6,8-9,12-14,20H,7,10-11,15H2,1-3H3,(H,30,33)/t20-/m0/s1
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| InChIKey |
OCEWKAHCFHSHRE-FQEVSTJZSA-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