General Information of the Compound
| Compound ID |
CP0486415
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| Compound Name |
1-{1-[3-((S)-2-Chloro-5-methyl-phenoxy)-2-hydroxy-propyl]-piperidin-4-yl}-1,3-dihydro-benzoimidazol-2-one
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| Structure |
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| Formula |
C22H26ClN3O3
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| Molecular Weight |
415.921
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| Canonical SMILES |
Cc1ccc(Cl)c(OC[C@@H](O)CN2CCC(CC2)n2c3ccccc3[nH]c2=O)c1
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| InChI |
InChI=1S/C22H26ClN3O3/c1-15-6-7-18(23)21(12-15)29-14-17(27)13-25-10-8-16(9-11-25)26-20-5-3-2-4-19(20)24-22(26)28/h2-7,12,16-17,27H,8-11,13-14H2,1H3,(H,24,28)/t17-/m0/s1
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| InChIKey |
OGMDLMRPSNGPOD-KRWDZBQOSA-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