General Information of the Compound
| Compound ID |
CP0539731
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| Compound Name |
1-acetyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]pyrrolidine-2-carboxamide
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| Structure |
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| Formula |
C23H34N4O2
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| Molecular Weight |
398.551
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| Canonical SMILES |
CC1CCCN1C1CCN(C1)c1ccc(NC(=O)C2CCCN2C(C)=O)cc1C
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| InChI |
InChI=1S/C23H34N4O2/c1-16-14-19(24-23(29)22-7-5-12-27(22)18(3)28)8-9-21(16)25-13-10-20(15-25)26-11-4-6-17(26)2/h8-9,14,17,20,22H,4-7,10-13,15H2,1-3H3,(H,24,29)
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| InChIKey |
HLXWQWSECJUMCI-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