General Information of the Compound
| Compound ID |
CP0037340
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| Compound Name |
4-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-yl)-1-methyl-1,2,3,6-tetrahydro-pyridine
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| Structure |
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| Formula |
C24H25N
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| Molecular Weight |
327.471
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| Canonical SMILES |
CN1CCC(=CC1)C1=Cc2ccccc2C(=C(C)C)c2ccccc12
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| InChI |
InChI=1S/C24H25N/c1-17(2)24-20-9-5-4-8-19(20)16-23(18-12-14-25(3)15-13-18)21-10-6-7-11-22(21)24/h4-12,16H,13-15H2,1-3H3
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| InChIKey |
BFTXVLUTUUBYLQ-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: PT01161, D(4) dopamine receptor