General Information of the Compound
| Compound ID |
CP0435171
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| Compound Name |
CHEMBL3237925
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| Formula |
C33H41Cl2N7O2
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| Molecular Weight |
638.644
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| Canonical SMILES |
CCCCC[C@@H](N1C(=O)C(=N[C@@]11CC[C@@H](CC1)C(C)(C)C)c1cc(Cl)cc(Cl)c1)c1ccc(cc1)C(=O)NCc1nn[nH]n1
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| InChI |
InChI=1S/C33H41Cl2N7O2/c1-5-6-7-8-27(21-9-11-22(12-10-21)30(43)36-20-28-38-40-41-39-28)42-31(44)29(23-17-25(34)19-26(35)18-23)37-33(42)15-13-24(14-16-33)32(2,3)4/h9-12,17-19,24,27H,5-8,13-16,20H2,1-4H3,(H,36,43)(H,38,39,40,41)/t24-,27-,33-/m1/s1
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| InChIKey |
HFXHLNFJXQIPEB-YVNJXZLRSA-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: PT01356, Glucagon-like peptide 1 receptor