General Information of the Compound
| Compound ID |
CP0944960
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| Compound Name |
(1-ethyl-6-(1-ethyl-1H-pyrazol-4-yl)-1H-benzo[d]imidazol-2-yl)diphenylmethanol
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| Structure |
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| Formula |
C27H26N4O
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| Molecular Weight |
422.532
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| Canonical SMILES |
CCn1cc(-c2ccc3nc(C(O)(c4ccccc4)c4ccccc4)n(CC)c3c2)cn1
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| InChI |
InChI=1S/C27H26N4O/c1-3-30-19-21(18-28-30)20-15-16-24-25(17-20)31(4-2)26(29-24)27(32,22-11-7-5-8-12-22)23-13-9-6-10-14-23/h5-19,32H,3-4H2,1-2H3
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| InChIKey |
HBJLMDYUBCSMLU-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