General Information of the Compound
| Compound ID |
CP0542183
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| Compound Name |
N-[2-(3-chlorophenyl)ethyl]-4-propan-2-yloxy-N-pyrrolidin-3-ylbenzamide
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| Structure |
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| Formula |
C22H27ClN2O2
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| Molecular Weight |
386.923
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| Canonical SMILES |
CC(C)Oc1ccc(cc1)C(=O)N(CCc1cccc(Cl)c1)C1CCNC1
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| InChI |
InChI=1S/C22H27ClN2O2/c1-16(2)27-21-8-6-18(7-9-21)22(26)25(20-10-12-24-15-20)13-11-17-4-3-5-19(23)14-17/h3-9,14,16,20,24H,10-13,15H2,1-2H3
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| InChIKey |
KWEUAJVHHBNKAT-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