General Information of the Compound
| Compound ID |
CP0958052
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| Compound Name |
(R)-2-(hydroxydiphenylmethyl)-N-(2-hydroxypropyl)-1-((tetrahydro-2H-pyran-4-yl)methyl)-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C30H33N3O4
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| Molecular Weight |
499.611
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| Canonical SMILES |
C[C@@H](O)CNC(=O)c1ccc2nc(C(O)(c3ccccc3)c3ccccc3)n(CC3CCOCC3)c2c1
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| InChI |
InChI=1S/C30H33N3O4/c1-21(34)19-31-28(35)23-12-13-26-27(18-23)33(20-22-14-16-37-17-15-22)29(32-26)30(36,24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-13,18,21-22,34,36H,14-17,19-20H2,1H3,(H,31,35)/t21-/m1/s1
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| InChIKey |
MKHOHZXADWZZSW-OAQYLSRUSA-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