General Information of the Compound
| Compound ID |
CP0417883
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| Compound Name |
10-Allyl-11-hydroxy-N-methylaporphine
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| Structure |
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| Formula |
C20H21NO
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| Molecular Weight |
291.394
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| Canonical SMILES |
CN1CCc2cccc-3c2[C@H]1Cc1ccc(CC=C)c(O)c-31
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| InChI |
InChI=1S/C20H21NO/c1-3-5-14-8-9-15-12-17-18-13(10-11-21(17)2)6-4-7-16(18)19(15)20(14)22/h3-4,6-9,17,22H,1,5,10-12H2,2H3/t17-/m1/s1
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| InChIKey |
BWQTWPFTINQQEK-QGZVFWFLSA-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT01195, D(1A) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor