General Information of the Compound
| Compound ID |
CP0277803
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| Compound Name |
N-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl]pyridin-2-amine
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| Structure |
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| Formula |
C19H24Cl2N4
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| Molecular Weight |
379.335
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| Canonical SMILES |
Clc1cccc(N2CCN(CCCCNc3ccccn3)CC2)c1Cl
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| InChI |
InChI=1S/C19H24Cl2N4/c20-16-6-5-7-17(19(16)21)25-14-12-24(13-15-25)11-4-3-10-23-18-8-1-2-9-22-18/h1-2,5-9H,3-4,10-15H2,(H,22,23)
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| InChIKey |
HGJYUXFMUSKRHL-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