UCSF

ZINC28565635

Substance Information

In ZINC since Heavy atoms Benign functionality
March 2nd, 2009 12 No

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) -3.69 -1.9 -76.2 4 6 -1 128 194.103 3
Mid Mid (pH 6-8) -3.69 -0.75 -155.58 3 6 -2 131 193.095 3

Activity (Go SEA)

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