UCSF

ZINC07607778

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 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) 0.42 5.24 -49.26 2 5 1 54 250.322 5
Hi High (pH 8-9.5) 0.42 3.04 -18.74 1 5 0 53 249.314 5

Activity (Go SEA)

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