General Information of the Compound
| Compound ID |
CP0437876
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| Compound Name |
3-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one
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| Structure |
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| Formula |
C23H29ClN4O
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| Molecular Weight |
412.965
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| Canonical SMILES |
Clc1cccc(c1)N1CCN(CCC(=O)N2CCN(CC2)c2ccccc2)CC1
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| InChI |
InChI=1S/C23H29ClN4O/c24-20-5-4-8-22(19-20)27-13-11-25(12-14-27)10-9-23(29)28-17-15-26(16-18-28)21-6-2-1-3-7-21/h1-8,19H,9-18H2
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| InChIKey |
UGOOGGORXNPCPF-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7