General Information of the Compound
| Compound ID |
CP0508124
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| Compound Name |
7-({2-[4-(1H-Indol-5-ylmethyl)-piperazin-1-yl]-ethyl}-propyl-amino)-5,6,7,8-tetrahydro-naphthalen-2-ol
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| Structure |
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| Formula |
C28H38N4O
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| Molecular Weight |
446.639
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| Canonical SMILES |
CCCN(CCN1CCN(Cc2ccc3[nH]ccc3c2)CC1)C1CCc2ccc(O)cc2C1
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| InChI |
InChI=1S/C28H38N4O/c1-2-11-32(26-6-4-23-5-7-27(33)20-25(23)19-26)17-16-30-12-14-31(15-13-30)21-22-3-8-28-24(18-22)9-10-29-28/h3,5,7-10,18,20,26,29,33H,2,4,6,11-17,19,21H2,1H3
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| InChIKey |
WSQNSMNIIQXLQN-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: PT00957, D(2) dopamine receptor
Protein ID: PT01366, D(3) dopamine receptor