General Information of the Compound
| Compound ID |
CP0533971
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| Compound Name |
2-methyl-1-[[(2R)-oxolan-2-yl]methyl]-6-[4-(pyrrolidin-1-ylmethyl)phenyl]benzimidazole
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| Structure |
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| Formula |
C24H29N3O
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| Molecular Weight |
375.516
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| Canonical SMILES |
Cc1nc2ccc(cc2n1C[C@H]1CCCO1)-c1ccc(CN2CCCC2)cc1
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| InChI |
InChI=1S/C24H29N3O/c1-18-25-23-11-10-21(15-24(23)27(18)17-22-5-4-14-28-22)20-8-6-19(7-9-20)16-26-12-2-3-13-26/h6-11,15,22H,2-5,12-14,16-17H2,1H3/t22-/m1/s1
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| InChIKey |
WBLHVRHAAPIFKV-JOCHJYFZSA-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