UCSF

ZINC39014423

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2010 33 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) 0.32 -5.82 -15.36 6 12 0 189 466.395 5
Hi High (pH 8-9.5) 0.32 -4.83 -57.7 5 12 -1 191 465.387 5

Activity (Go SEA)

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