General Information of the Compound
| Compound ID |
CP0321301
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| Compound Name |
N-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl]-5-phenylpyridin-2-amine
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| Structure |
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| Formula |
C25H28Cl2N4
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| Molecular Weight |
455.433
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| Canonical SMILES |
Clc1cccc(N2CCN(CCCCNc3ccc(cn3)-c3ccccc3)CC2)c1Cl
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| InChI |
InChI=1S/C25H28Cl2N4/c26-22-9-6-10-23(25(22)27)31-17-15-30(16-18-31)14-5-4-13-28-24-12-11-21(19-29-24)20-7-2-1-3-8-20/h1-3,6-12,19H,4-5,13-18H2,(H,28,29)
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| InChIKey |
WRUSBTCFXKDYJC-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor