UCSF

ZINC76945664

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2012 23 No

Popular Name: Sulpho HSAB Sulpho HSAB

Find On: PubMed — Wikipedia — Google

CAS Number: 199804-22-3

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) -0.99 1.11 -49.37 0 11 -1 171 339.265 5 ↓

Vendor Notes

Note Type Comments Provided By
Notes Photoreactive -Primary amine reactive -Water solubleRef: Galardy,R.E, et al(1974)J.Biol.Chem. 249, 3510-3518 Apollo Scientific Bioactives

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.