General Information of the Compound
Compound ID |
CP0904611
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Compound Name |
(R)-2-(hydroxydiphenylmethyl)-N-(2-hydroxypropyl)-1-(oxetan-3-yl)-1H-benzo[d]imidazole-6-carboxamide
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Structure |
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Formula |
C27H27N3O4
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Molecular Weight |
457.53
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Canonical SMILES |
C[C@@H](O)CNC(=O)c1ccc2nc(C(O)(c3ccccc3)c3ccccc3)n(C3COC3)c2c1
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InChI |
InChI=1S/C27H27N3O4/c1-18(31)15-28-25(32)19-12-13-23-24(14-19)30(22-16-34-17-22)26(29-23)27(33,20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-14,18,22,31,33H,15-17H2,1H3,(H,28,32)/t18-/m1/s1
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InChIKey |
WSZNADZVOCEZLB-GOSISDBHSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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