General Information of the Compound
| Compound ID |
CP0491702
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| Compound Name |
N-hydroxy-4-[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenoxy]benzamide
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| Structure |
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| Formula |
C25H26N2O4
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| Molecular Weight |
418.493
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| Canonical SMILES |
COc1ccc(cc1)C1CCCN1Cc1ccc(Oc2ccc(cc2)C(=O)NO)cc1
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| InChI |
InChI=1S/C25H26N2O4/c1-30-21-12-6-19(7-13-21)24-3-2-16-27(24)17-18-4-10-22(11-5-18)31-23-14-8-20(9-15-23)25(28)26-29/h4-15,24,29H,2-3,16-17H2,1H3,(H,26,28)
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| InChIKey |
DLQCQSHURGAKKI-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