General Information of the Compound
| Compound ID |
CP0411600
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
CHEMBL3237919
Show/Hide
|
||||||||||||||||||
| Formula |
C30H35Cl2N3O5
|
||||||||||||||||||
| Molecular Weight |
588.532
|
||||||||||||||||||
| 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)NC[C@@H](O)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H35Cl2N3O5/c1-17(18-5-7-19(8-6-18)26(37)33-16-24(36)28(39)40)35-27(38)25(20-13-22(31)15-23(32)14-20)34-30(35)11-9-21(10-12-30)29(2,3)4/h5-8,13-15,17,21,24,36H,9-12,16H2,1-4H3,(H,33,37)(H,39,40)/t17-,21-,24-,30-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
XNOZTIIHBPWVBB-FLWSHOJRSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01473, Glucagon receptor
Protein ID: PT01356, Glucagon-like peptide 1 receptor