General Information of the Compound
| Compound ID |
CP0373154
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| Compound Name |
(4aR,10aR)-1-propyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinoline-6,7-diol
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| Structure |
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| Formula |
C16H23NO2
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| Molecular Weight |
261.365
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| Canonical SMILES |
CCCN1CCC[C@@H]2Cc3c(C[C@@H]12)ccc(O)c3O
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| InChI |
InChI=1S/C16H23NO2/c1-2-7-17-8-3-4-12-9-13-11(10-14(12)17)5-6-15(18)16(13)19/h5-6,12,14,18-19H,2-4,7-10H2,1H3/t12-,14-/m1/s1
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| InChIKey |
HZPDHOOVQQYBJP-TZMCWYRMSA-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