General Information of the Compound
| Compound ID |
CP0147411
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| Compound Name |
4-[5-(4-Chloro-phenyl)-3-(2-hexyloxy-phenyl)-1H-pyrrol-2-yl]-pyridine
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| Structure |
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| Formula |
C27H27ClN2O
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| Molecular Weight |
430.979
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| Canonical SMILES |
CCCCCCOc1ccccc1-c1cc([nH]c1-c1ccncc1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C27H27ClN2O/c1-2-3-4-7-18-31-26-9-6-5-8-23(26)24-19-25(20-10-12-22(28)13-11-20)30-27(24)21-14-16-29-17-15-21/h5-6,8-17,19,30H,2-4,7,18H2,1H3
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| InChIKey |
ODJAAXUMRRFNRJ-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: PT01473, Glucagon receptor
Protein ID: PT06074, Glucagon receptor