General Information of the Compound
| Compound ID |
CP0874665
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| Compound Name |
2-((4-fluorophenyl)(hydroxy)(3-methylpyridin-2-yl)methyl)-N-((R)-2-hydroxypropyl)-1-methyl-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C25H25FN4O3
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| Molecular Weight |
448.498
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| Canonical SMILES |
Cc1cccnc1C(O)(c1ccc(F)cc1)c1nc2ccc(C(=O)NC[C@@H](C)O)cc2n1C
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| InChI |
InChI=1S/C25H25FN4O3/c1-15-5-4-12-27-22(15)25(33,18-7-9-19(26)10-8-18)24-29-20-11-6-17(13-21(20)30(24)3)23(32)28-14-16(2)31/h4-13,16,31,33H,14H2,1-3H3,(H,28,32)/t16-,25?/m1/s1
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| InChIKey |
LHPMAQSABZZYGN-ZRTDVJLTSA-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