General Information of the Compound
| Compound ID |
CP0186273
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| Compound Name |
1-(1-{3-[1-Benzoyl-3-(3,4-dichloro-phenyl)-piperidin-3-yl]-propyl}-piperidin-4-yl)-1,3-dihydro-benzoimidazol-2-one
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| Structure |
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| Formula |
C33H36Cl2N4O2
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| Molecular Weight |
591.583
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| Canonical SMILES |
Clc1ccc(cc1Cl)C1(CCCN2CCC(CC2)n2c3ccccc3[nH]c2=O)CCCN(C1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C33H36Cl2N4O2/c34-27-13-12-25(22-28(27)35)33(17-7-19-38(23-33)31(40)24-8-2-1-3-9-24)16-6-18-37-20-14-26(15-21-37)39-30-11-5-4-10-29(30)36-32(39)41/h1-5,8-13,22,26H,6-7,14-21,23H2,(H,36,41)
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| InChIKey |
ODPRNYGWGVRXIG-UHFFFAOYSA-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