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Ligand Name: (6-Phenoxy-1,2,3,4-tetrahydronaphthalen-2-yl)(5-(pyridin-2-yl)oxazol-2-yl)methanone |
Ligand Type: non-polymer |
Ligand ID: COVPDB1183 |
PubChem:
52950980
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Synonym(s):
- chembl1765831
- bdbm50342065
- (s)-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-2-yl)(5-(pyridin-2-yl)oxazol-2-yl)methanone
show 2 synonym(s)
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DrugBank: - |
ChEMBL: CHEMBL1765831 |
Canonical SMILES: c1cccnc1-c2oc(nc2)C(=O)[C@H](C3)CCc(c34)cc(cc4)Oc5ccccc5 |
Standard InChI: InChI=1S/C25H20N2O3/c28-24(25-27-16-23(30-25)22-8-4-5-13-26-22)19-10-9-18-15-21(12-11-17(18)14-19)29-20-6-2-1-3-7-20/h1-8,11-13,15-16,19H,9-10,14H2/t19-/m0/s1 |
Molecular Formula: C25H20N2O3 |
Mol. Weight: 396.1474 |
logP: 5.5167 |
HBD: 0 | HBA: 5 |
#Rotatable Bonds: 5 | TPSA: 65.22 |