UCSF

ZINC06926686

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2006 20 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) 3.57 4.09 -41.37 1 4 -1 64 301.372 3
Hi High (pH 8-9.5) 4.52 2.82 -45.47 1 4 -1 69 301.372 2

Activity (Go SEA)

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