UCSF

ZINC38465391

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2010 28 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) 4.77 11.13 -34.55 2 3 1 34 384.584 5
Hi High (pH 8-9.5) 4.77 8.56 -5.49 1 3 0 33 383.576 5

Activity (Go SEA)

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