General Information of the Compound
| Compound ID |
CP0930858
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| Compound Name |
N-(3,5-bis(trifluoromethyl)phenyl)-3-isopropyl-1-(2-methyl-6-(2-(pyrrolidin-1-yl)ethyl)phenyl)-5-oxopyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C29H33F6N3O2
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| Molecular Weight |
569.59
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| Canonical SMILES |
Cc1cccc(CCN2CCCC2)c1N1CC(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(C(C)C)CC1=O
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| InChI |
InChI=1S/C29H33F6N3O2/c1-18(2)27(26(40)36-23-14-21(28(30,31)32)13-22(15-23)29(33,34)35)16-24(39)38(17-27)25-19(3)7-6-8-20(25)9-12-37-10-4-5-11-37/h6-8,13-15,18H,4-5,9-12,16-17H2,1-3H3,(H,36,40)
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| InChIKey |
XPSMLFADKUFBBP-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