UCSF

ZINC37790038

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 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) 2.86 8.04 -39.76 2 4 1 43 299.822 9
Hi High (pH 8-9.5) 2.86 5.52 -9.85 1 4 0 42 298.814 9

Activity (Go SEA)

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