 |
| Ligand Name: Carbapenem T210 |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB304 |
PubChem:
57357591
|
Synonym(s):
- schembl9428592
- dtxsid20723749
- pubchem_57357591
- bmy-27946
- 163580-66-3
- (4r,5s,6s)-6-[(1r)-1-hydroxyethyl]-4-methyl-3-methylsulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
show 5 synonym(s)
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: CSC1=C(N2[C@@H]([C@@H]([C@@H](C)O)C2=O)[C@H]1C)C(O)=O |
| Standard InChI: InChI=1S/C11H15NO4S/c1-4-7-6(5(2)13)10(14)12(7)8(11(15)16)9(4)17-3/h4-7,13H,1-3H3,(H,15,16)/t4-,5-,6-,7-/m1/s1 |
| Molecular Formula: C11H15NO4S |
Mol. Weight: 257.07217 |
logP: 0.5031 |
| HBD: 2 | HBA: 4 |
| #Rotatable Bonds: 3 | TPSA: 77.84 |