General Information of the Compound
| Compound ID |
CP0473557
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| Compound Name |
N-(9H-fluoren-2-ylmethyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propylbutan-1-amine
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| Structure |
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| Formula |
C32H41N3O
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| Molecular Weight |
483.7
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| Canonical SMILES |
CCCN(CCCCN1CCN(CC1)c1ccccc1OC)Cc1ccc-2c(Cc3ccccc-23)c1
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| InChI |
InChI=1S/C32H41N3O/c1-3-16-34(25-26-14-15-30-28(23-26)24-27-10-4-5-11-29(27)30)18-9-8-17-33-19-21-35(22-20-33)31-12-6-7-13-32(31)36-2/h4-7,10-15,23H,3,8-9,16-22,24-25H2,1-2H3
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| InChIKey |
HUKSBDBJOJSVHS-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