General Information of the Compound
| Compound ID |
CP0525463
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| Compound Name |
2-Phenyl-3-(2-pyrrolidin-1-yl-ethyl)-1H-indole
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| Structure |
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| Formula |
C20H22N2
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| Molecular Weight |
290.41
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| Canonical SMILES |
C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCCC1
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| InChI |
InChI=1S/C20H22N2/c1-2-8-16(9-3-1)20-18(12-15-22-13-6-7-14-22)17-10-4-5-11-19(17)21-20/h1-5,8-11,21H,6-7,12-15H2
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| InChIKey |
QGQVKTDTPMQADW-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: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT01005, D(2) dopamine receptor