General Information of the Compound
| Compound ID |
CP0394000
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| Compound Name |
3-(1-(1,2-dihydroacenaphthylen-1-yl)piperidin-4-yl)-6-fluoro-1H-indole
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| Structure |
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| Formula |
C25H23FN2
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| Molecular Weight |
370.471
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| Canonical SMILES |
Fc1ccc2c(c[nH]c2c1)C1CCN(CC1)C1Cc2cccc3cccc1c23
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| InChI |
InChI=1S/C25H23FN2/c26-19-7-8-20-22(15-27-23(20)14-19)16-9-11-28(12-10-16)24-13-18-5-1-3-17-4-2-6-21(24)25(17)18/h1-8,14-16,24,27H,9-13H2
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| InChIKey |
DVBJVGHTTIHWNV-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
Protein ID: PT01200, Delta-type opioid receptor
Protein ID: PT00983, Kappa-type opioid receptor
Protein ID: PT01515, Mu-type opioid receptor
Protein ID: PT01360, Nociceptin receptor