UCSF

ZINC00508214

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 21 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) 1.08 4.63 -45.48 1 7 -1 99 304.307 5
Hi High (pH 8-9.5) 2.46 3.89 -47.89 1 7 -1 104 304.307 4

Activity (Go SEA)

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