Bioactive Compound Details

BioIDbio199708
NamePENICILLIN G POTASSIUM
ChEMBL IDCHEMBL1223
Molecular FormulaC16H17KN2O4S
Molecular Weight372.49
Molecular Weight (Monoisotopic)334.0987
TypeSmall molecule
Max PhasePhase 4
Target IDTar81
Target NameNone
SynonymsBENZYLPENICILLIN POTASSIUM|Cilloral|E705|Liquapen|NSC-131815|PENICILLIN|PENICILLIN G POTASSIUM|PENICILLIN G POTASSIUM SALT|PENICILLIN POTASSIUM G, CRYSTALLINE|PENICILLIN-2|PENTIDS '200'|PENTIDS '250'|PENTIDS '400'|PENTIDS '800'|PFIZERPEN|PFIZERPEN G|Penicillin G Potassium|Penicillin-2|Pfizerpen|Pfizerpen G|Scotcil
SmilesCC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)[O-].[K+]
InchiInChI=1S/C16H18N2O4S.K/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);/q;+1/p-1/t11-,12+,14-;/m1./s1
Inchi KeyIYNDLOXRXUOGIU-LQDWTQKMSA-M
Molecular SpeciesACID
Targets13.0
Bioactivities27.0
Np Likeness Score0.34
Records Key['Benzyl penicillin potassium', 'SID56422871', 'benzylpenicillin potassium salt', 'SID855606', 'Penicillin G', 'PENICILLIN G POTASSIUM', 'penicillin G potassium salt', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM']
Records Name['Potassium salt of 3,3-dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylate (Benzyl penicillin potassium)', 'SID56422871', 'benzylpenicillin potassium salt', 'SID855606', 'Penicillin G potassium salt', 'PENICILLIN G POTASSIUM', 'penicillin G potassium salt', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', None, 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM', 'PENICILLIN G POTASSIUM']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure