UCSF

ZINC01301967

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 18 No

Other Names:

MFCD01925357

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) 2.29 8.5 -13.95 1 3 0 38 274.37 1
Mid Mid (pH 6-8) 2.75 8.06 -44.07 0 3 -1 41 273.362 1

Activity (Go SEA)

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