General Information of the Compound
| Compound ID |
CP0071763
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| Compound Name |
N-[4-[4-(2-hydroxyphenyl)piperazin-1-yl]butyl]naphthalene-2-carboxamide
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| Structure |
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| Formula |
C25H29N3O2
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| Molecular Weight |
403.526
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| Canonical SMILES |
Oc1ccccc1N1CCN(CCCCNC(=O)c2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C25H29N3O2/c29-24-10-4-3-9-23(24)28-17-15-27(16-18-28)14-6-5-13-26-25(30)22-12-11-20-7-1-2-8-21(20)19-22/h1-4,7-12,19,29H,5-6,13-18H2,(H,26,30)
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| InChIKey |
UGRYVQVSCSWCQH-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