UCSF

ZINC16909712

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 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) 3.92 8.91 -49 1 6 -1 95 353.379 5
Ref Reference (pH 7) 3.43 8.8 -90.67 0 6 -2 93 352.371 6

Activity (Go SEA)

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