General Information of the Compound
| Compound ID |
CP0534658
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| Compound Name |
4-(benzimidazol-1-ylmethyl)-N-methyl-N-[(3R)-1-propan-2-ylpyrrolidin-3-yl]benzamide
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| Structure |
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| Formula |
C23H28N4O
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| Molecular Weight |
376.504
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| Canonical SMILES |
CC(C)N1CC[C@H](C1)N(C)C(=O)c1ccc(Cn2cnc3ccccc23)cc1
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| InChI |
InChI=1S/C23H28N4O/c1-17(2)26-13-12-20(15-26)25(3)23(28)19-10-8-18(9-11-19)14-27-16-24-21-6-4-5-7-22(21)27/h4-11,16-17,20H,12-15H2,1-3H3/t20-/m1/s1
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| InChIKey |
NHXHNDYJIBDZJX-HXUWFJFHSA-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