General Information of the Compound
| Compound ID |
CP0393872
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| Compound Name |
CHEMBL51542
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| Formula |
C26H29F3N2O2S
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| Molecular Weight |
490.591
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| Canonical SMILES |
FC(F)(F)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C26H29F3N2O2S/c27-26(28,29)24-7-3-4-8-25(24)34(32,33)31-18-20-11-9-19(10-12-20)16-30-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,13-15,19-20,30-31H,9-12,16-18H2/t19-,20-
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| InChIKey |
BNIKBNAQLLLYDP-MXVIHJGJSA-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: PT02259, Neuropeptide Y receptor type 1
Protein ID: PT01795, Neuropeptide Y receptor type 5