UCSF

ZINC59717285

Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2011 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) 5.80 11.22 -37.31 2 2 1 29 277.476 13
Hi High (pH 8-9.5) 5.80 9.86 -3.26 1 2 0 25 276.468 13

Activity (Go SEA)

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