UCSF

ZINC44841281

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2010 13 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) -0.80 -0.44 -6.9 3 4 0 67 204.295 5

Activity (Go SEA)

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