UCSF

ZINC25693742

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2009 28 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) 1.94 0.35 -44.55 1 9 -1 129 421.842 5
Ref Reference (pH 7) 1.94 1.65 -50.93 1 9 -1 129 421.842 5

Activity (Go SEA)

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