General Information of the Compound
| Compound ID |
CP0411599
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| Compound Name |
CHEMBL3238225
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| Formula |
C35H47N7O3
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| Molecular Weight |
613.807
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| Canonical SMILES |
COc1ccc(cc1)C1=N[C@@]2(CC[C@@H](CC2)C(C)(C)C)N([C@H](CCC(C)(C)C)c2ccc(cc2)C(=O)NCc2nn[nH]n2)C1=O
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| InChI |
InChI=1S/C35H47N7O3/c1-33(2,3)19-18-28(23-8-10-25(11-9-23)31(43)36-22-29-38-40-41-39-29)42-32(44)30(24-12-14-27(45-7)15-13-24)37-35(42)20-16-26(17-21-35)34(4,5)6/h8-15,26,28H,16-22H2,1-7H3,(H,36,43)(H,38,39,40,41)/t26-,28-,35-/m1/s1
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| InChIKey |
CLUJBHXFHKEVAR-JAHNLGOSSA-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