General Information of the Compound
| Compound ID |
CP0860429
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| Compound Name |
1-Methylapomorphine Hydrochloride
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| Structure |
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| Formula |
C18H20ClNO2
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| Molecular Weight |
317.816
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| Canonical SMILES |
Cc1ccc2c3c1-c1c(ccc(O)c1O)C[C@H]3N(C)CC2.Cl
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| InChI |
InChI=1S/C18H19NO2.ClH/c1-10-3-4-11-7-8-19(2)13-9-12-5-6-14(20)18(21)17(12)15(10)16(11)13;/h3-6,13,20-21H,7-9H2,1-2H3;1H/t13-;/m1./s1
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| InChIKey |
DSKGEPOZUVDBND-BTQNPOSSSA-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: PT01195, D(1A) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor