UCSF

ZINC18173392

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2008 37 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) 8.39 19.14 -14.85 0 4 0 39 520.057 5
Ref Reference (pH 7) 8.39 17.91 -13.92 0 4 0 39 520.057 5

Activity (Go SEA)

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