UCSF

ZINC32445474

Substance Information

In ZINC since Heavy atoms Benign functionality
April 30th, 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) 1.30 5.6 -122.7 4 2 2 32 210.296 3
Hi High (pH 8-9.5) 1.30 5.25 -36.2 3 2 1 30 209.288 3
Mid Mid (pH 6-8) 1.30 3.16 -47.15 3 2 1 31 209.288 3

Vendor Notes

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

Activity (Go SEA)

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