UCSF

ZINC04007921

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 16 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) 1.06 3.45 -8.47 2 3 0 56 212.252 3
Lo Low (pH 4.5-6) 1.06 3.73 -34.03 3 3 1 57 213.26 3

Vendor Notes

Note Type Comments Provided By
MP 136 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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