General Information of the Compound
| Compound ID |
CP0875646
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| Compound Name |
(6aR)-O10-(3-Aminopropyl)apomorphine
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| Structure |
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| Formula |
C20H24N2O2
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| Molecular Weight |
324.424
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| Canonical SMILES |
CN1CCc2cccc3c2[C@H]1Cc1ccc(OCCCN)c(O)c1-3
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| InChI |
InChI=1S/C20H24N2O2/c1-22-10-8-13-4-2-5-15-18(13)16(22)12-14-6-7-17(20(23)19(14)15)24-11-3-9-21/h2,4-7,16,23H,3,8-12,21H2,1H3/t16-/m1/s1
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| InChIKey |
BYNOKCOVEBNKRF-MRXNPFEDSA-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