General Information of the Compound
| Compound ID |
CP0521467
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| Compound Name |
CHEMBL3325745
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| Formula |
C20H25NO
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| Molecular Weight |
295.426
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| Canonical SMILES |
CN(C)[C@@]1(CC[C@](O)(CC1)c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C20H25NO/c1-21(2)19(17-9-5-3-6-10-17)13-15-20(22,16-14-19)18-11-7-4-8-12-18/h3-12,22H,13-16H2,1-2H3/t19-,20+
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| InChIKey |
JUUXBSSXSLHJHP-BGYRXZFFSA-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: PT01515, Mu-type opioid receptor
Protein ID: PT01360, Nociceptin receptor