UCSF

ZINC16227482

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2008 30 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) 1.37 2.14 -27.39 2 10 0 130 432.458 7
Hi High (pH 8-9.5) 1.83 0.4 -59.65 1 10 -1 133 431.45 7

Activity (Go SEA)

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