General Information of the Compound
| Compound ID |
CP0418838
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| Compound Name |
CHEMBL165381
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| Formula |
C18H32N4
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| Molecular Weight |
304.482
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| Canonical SMILES |
CCCN(CCC)CC[C@H]1CC[C@@H](CC1)Nc1ncccn1
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| InChI |
InChI=1S/C18H32N4/c1-3-13-22(14-4-2)15-10-16-6-8-17(9-7-16)21-18-19-11-5-12-20-18/h5,11-12,16-17H,3-4,6-10,13-15H2,1-2H3,(H,19,20,21)/t16-,17-
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| InChIKey |
QOGRQXGQKOEKKF-QAQDUYKDSA-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