UCSF

ZINC00928293

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.93 0.27 -11.79 0 4 0 48 359.472 6
Lo Low (pH 4.5-6) 3.93 0.41 -33.79 1 4 1 49 360.48 6

Activity (Go SEA)

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