General Information of the Compound
| Compound ID |
CP0040488
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| Compound Name |
(R)-1-(1-(4-methoxybenzyl)-1H-benzo[d]imidazol-2-yl)-N,N-dimethylpyrrolidin-3-amine
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| Structure |
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| Formula |
C21H26N4O
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| Molecular Weight |
350.466
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| Canonical SMILES |
COc1ccc(Cn2c(nc3ccccc23)N2CC[C@H](C2)N(C)C)cc1
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| InChI |
InChI=1S/C21H26N4O/c1-23(2)17-12-13-24(15-17)21-22-19-6-4-5-7-20(19)25(21)14-16-8-10-18(26-3)11-9-16/h4-11,17H,12-15H2,1-3H3/t17-/m1/s1
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| InChIKey |
ZCRCTVHOBQJBNB-QGZVFWFLSA-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
Protein ID: PT01206, Histamine H1 receptor
Protein ID: PT01310, Muscarinic acetylcholine receptor M1