UCSF

ZINC34885464

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 24 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) -1.80 -2.82 -71.97 8 10 1 156 357.416 6
Hi High (pH 8-9.5) -1.08 -3.23 -84.74 7 10 0 153 356.408 6

Activity (Go SEA)

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