General Information of the Compound
| Compound ID |
CP0944446
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| Compound Name |
(R)-1-(2-aminoethyl)-2-(hydroxydiphenylmethyl)-N-(2-hydroxypropyl)-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C26H28N4O3
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| Molecular Weight |
444.535
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| Canonical SMILES |
C[C@@H](O)CNC(=O)c1ccc2nc(C(O)(c3ccccc3)c3ccccc3)n(CCN)c2c1
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| InChI |
InChI=1S/C26H28N4O3/c1-18(31)17-28-24(32)19-12-13-22-23(16-19)30(15-14-27)25(29-22)26(33,20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-13,16,18,31,33H,14-15,17,27H2,1H3,(H,28,32)/t18-/m1/s1
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| InChIKey |
IEQJYCPKOKHXNC-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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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