General Information of the Compound
| Compound ID |
CP0717117
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| Compound Name |
4-chloro-N-(4-(4-(2-chlorophenyl)piperazin-1-yl)butyl)benzamide
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| Structure |
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| Formula |
C21H25Cl2N3O
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| Molecular Weight |
406.357
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| Canonical SMILES |
O=C(NCCCCN1CCN(c2ccccc2Cl)CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H25Cl2N3O/c22-18-9-7-17(8-10-18)21(27)24-11-3-4-12-25-13-15-26(16-14-25)20-6-2-1-5-19(20)23/h1-2,5-10H,3-4,11-16H2,(H,24,27)
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| InChIKey |
FZQRWGRFKDAQAI-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
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor