General Information of the Compound
| Compound ID |
CP0380731
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| Compound Name |
1'-phenethyl-3-phenylspiro[2,4,5,6-tetrahydrocyclopenta[c]pyrazole-6,4'-(hexahydropyridine)]
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| Structure |
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| Formula |
C24H27N3
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| Molecular Weight |
357.501
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| Canonical SMILES |
C(Cc1ccccc1)N1CCC2(CCc3c(n[nH]c23)-c2ccccc2)CC1
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| InChI |
InChI=1S/C24H27N3/c1-3-7-19(8-4-1)12-16-27-17-14-24(15-18-27)13-11-21-22(25-26-23(21)24)20-9-5-2-6-10-20/h1-10H,11-18H2,(H,25,26)
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| InChIKey |
VOWFPVSNWUSCMB-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