General Information of the Compound
| Compound ID |
CP0419924
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| Compound Name |
CHEMBL3237918
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| Formula |
C28H31Cl2N7O2
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| Molecular Weight |
568.509
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| Canonical SMILES |
C[C@@H](N1C(=O)C(=N[C@@]11CC[C@@H](CC1)C(C)(C)C)c1cc(Cl)cc(Cl)c1)c1ccc(cc1)C(=O)Nc1nnn[nH]1
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| InChI |
InChI=1S/C28H31Cl2N7O2/c1-16(17-5-7-18(8-6-17)24(38)31-26-33-35-36-34-26)37-25(39)23(19-13-21(29)15-22(30)14-19)32-28(37)11-9-20(10-12-28)27(2,3)4/h5-8,13-16,20H,9-12H2,1-4H3,(H2,31,33,34,35,36,38)/t16-,20-,28-/m1/s1
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| InChIKey |
PFOUJNFXNRYXCU-FYOXXRTDSA-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