General Information of the Compound
| Compound ID |
CP0457671
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| Compound Name |
N-(9-ethylcarbazol-3-yl)-3-[4-(2-fluorophenyl)triazol-1-yl]propanamide
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| Structure |
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| Formula |
C25H22FN5O
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| Molecular Weight |
427.483
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| Canonical SMILES |
CCn1c2ccccc2c2cc(NC(=O)CCn3cc(nn3)-c3ccccc3F)ccc12
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| InChI |
InChI=1S/C25H22FN5O/c1-2-31-23-10-6-4-7-18(23)20-15-17(11-12-24(20)31)27-25(32)13-14-30-16-22(28-29-30)19-8-3-5-9-21(19)26/h3-12,15-16H,2,13-14H2,1H3,(H,27,32)
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| InChIKey |
YGLUVTVRMKRTQV-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2