General Information of the Compound
| Compound ID |
CP0890906
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| Compound Name |
(6aR,S)-N-n-Propylnoraporphin-11-ylethylcarbamate
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| Structure |
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| Formula |
C22H26N2O2
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| Molecular Weight |
350.462
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| Canonical SMILES |
CCCN1CCc2cccc3c2C1Cc1cccc(OC(=O)NCC)c1-3
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| InChI |
InChI=1S/C22H26N2O2/c1-3-12-24-13-11-15-7-5-9-17-20(15)18(24)14-16-8-6-10-19(21(16)17)26-22(25)23-4-2/h5-10,18H,3-4,11-14H2,1-2H3,(H,23,25)
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| InChIKey |
AUWJEOYYGQLWQK-UHFFFAOYSA-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