UCSF

ZINC32917438

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2009 15 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) 2.31 5.6 -31.57 2 2 1 16 211.373 2
Mid Mid (pH 6-8) 2.31 5.14 -39.13 2 2 1 20 211.373 2
Mid Mid (pH 6-8) 2.31 7.02 -101.44 3 2 2 21 212.381 2

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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