UCSF

ZINC05686903

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 25 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) 3.34 6.37 -17.51 2 7 0 92 339.399 4
Mid Mid (pH 6-8) 3.34 6.36 -18.42 2 7 0 92 339.399 4

Activity (Go SEA)

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