UCSF

ZINC35304503

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 15 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) -2.52 5.31 -45.67 1 6 0 89 213.237 6
Hi High (pH 8-9.5) -2.52 3.11 -55.08 0 6 -1 87 212.229 6

Activity (Go SEA)

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