General Information of the Compound
| Compound ID |
CP0502453
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| Compound Name |
(5,6-Dimethoxy-indan-2-yl)-[2-(3,4-dimethoxy-phenyl)-ethyl]-propyl-amine
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| Structure |
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| Formula |
C24H33NO4
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| Molecular Weight |
399.531
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| Canonical SMILES |
CCCN(CCc1ccc(OC)c(OC)c1)C1Cc2cc(OC)c(OC)cc2C1
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| InChI |
InChI=1S/C24H33NO4/c1-6-10-25(11-9-17-7-8-21(26-2)22(12-17)27-3)20-13-18-15-23(28-4)24(29-5)16-19(18)14-20/h7-8,12,15-16,20H,6,9-11,13-14H2,1-5H3
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| InChIKey |
PMEYCKNESWKUMY-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