General Information of the Compound
| Compound ID |
CP0449796
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| Compound Name |
4-phenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine
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| Structure |
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| Formula |
C21H22N2
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| Molecular Weight |
302.421
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| Canonical SMILES |
C1CC2N(CCc3c2[nH]c2ccccc32)C(C1)c1ccccc1
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| InChI |
InChI=1S/C21H22N2/c1-2-7-15(8-3-1)19-11-6-12-20-21-17(13-14-23(19)20)16-9-4-5-10-18(16)22-21/h1-5,7-10,19-20,22H,6,11-14H2
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| InChIKey |
ZPEMCDCOAWNLMW-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: PT01195, D(1A) dopamine receptor
Protein ID: PT01169, D(1B) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor