UCSF

ZINC05907158

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 18 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) 1.62 6.07 -45.98 1 6 -1 86 245.262 5
Hi High (pH 8-9.5) 1.62 3.44 -41.03 1 6 -1 82 245.262 5

Activity (Go SEA)

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