UCSF

ZINC33962340

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 5th, 2009 16 No

Popular Name: (2S,5R,6R)-6-amino-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic (2S,5R,6R)-6-amino-3,3-dimethyl-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -3.79 -2.84 -50.56 2 7 -1 121 247.252 1 ↓
Mid Mid (pH 6-8) -3.79 -2.52 -72.44 3 7 0 122 248.26 1 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4260598 IBM Patent Data

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )