General Information of the Compound
| Compound ID |
CP0458947
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| Compound Name |
4-(4-Benzyl-piperazin-1-yl)-1H-indole
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| Synonyms |
4-(4-Benzyl-piperazin-1-yl)-1H-indole
AC1MBNW0
BDBM50071857
CHEMBL328051
JLZIBIQTDGMAFZ-UHFFFAOYSA-N
Maybridge2_000682
Oprea1_014756
SCHEMBL2161609
ZINC53006914
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| Structure |
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| Formula |
C19H21N3
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| Molecular Weight |
291.398
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| Canonical SMILES |
C(N1CCN(CC1)c1cccc2[nH]ccc12)c1ccccc1
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| InChI |
InChI=1S/C19H21N3/c1-2-5-16(6-3-1)15-21-11-13-22(14-12-21)19-8-4-7-18-17(19)9-10-20-18/h1-10,20H,11-15H2
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| InChIKey |
JLZIBIQTDGMAFZ-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
Protein ID: PT01161, D(4) dopamine receptor
Clinical Information about the Compound