General Information of the Compound
| Compound ID |
CP0316388
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| Compound Name |
4-(8-Chloro-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 |
C24H24ClN
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| Molecular Weight |
361.916
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| Canonical SMILES |
CN1CCC(=CC1)C1=Cc2ccccc2C(=C(C)C)c2ccc(Cl)cc12
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| InChI |
InChI=1S/C24H24ClN/c1-16(2)24-20-7-5-4-6-18(20)14-22(17-10-12-26(3)13-11-17)23-15-19(25)8-9-21(23)24/h4-10,14-15H,11-13H2,1-3H3
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| InChIKey |
IAOUVQRCRUKJNM-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