UCSF

ZINC20981603

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2008 11 Yes

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) 0.09 0.93 -32.21 1 4 0 59 147.137 0
Mid Mid (pH 6-8) 0.08 1.64 -15.44 1 4 0 59 147.137 0
Mid Mid (pH 6-8) 0.54 0.52 -44.16 0 4 -1 62 146.129 0

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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