General Information of the Compound
| Compound ID |
CP0557298
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| Compound Name |
6-tert-butyl-2-[(2R)-pyrrolidin-2-yl]-1H-benzimidazole
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| Structure |
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| Formula |
C15H21N3
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| Molecular Weight |
243.354
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| Canonical SMILES |
CC(C)(C)c1ccc2[nH]c(nc2c1)[C@H]1CCCN1
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| InChI |
InChI=1S/C15H21N3/c1-15(2,3)10-6-7-11-13(9-10)18-14(17-11)12-5-4-8-16-12/h6-7,9,12,16H,4-5,8H2,1-3H3,(H,17,18)/t12-/m1/s1
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| InChIKey |
MGQJWVJWWDBNQW-GFCCVEGCSA-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