UCSF

ZINC35663095

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 20 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) 1.04 6.93 -13.92 0 6 0 63 276.292 7
Mid Mid (pH 6-8) 1.04 7.44 -37.77 1 6 1 64 277.3 7

Activity (Go SEA)

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