General Information of the Compound
| Compound ID |
CP0496607
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| Compound Name |
3-(1,4-Dimethyl-piperazin-2-yl)-2-phenyl-1H-indole
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| Structure |
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| Formula |
C20H23N3
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| Molecular Weight |
305.425
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| Canonical SMILES |
CN1CCN(C)C(C1)c1c([nH]c2ccccc12)-c1ccccc1
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| InChI |
InChI=1S/C20H23N3/c1-22-12-13-23(2)18(14-22)19-16-10-6-7-11-17(16)21-20(19)15-8-4-3-5-9-15/h3-11,18,21H,12-14H2,1-2H3
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| InChIKey |
SLAYQEHIFVRKNL-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01005, D(2) dopamine receptor