UCSF

ZINC06495261

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2006 30 Yes

CAS Number: 4449-51-8

Other Names:

MFCD01735266

MFCD09878269

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) 5.48 -3 -44.91 3 3 1 46 412.638 0

Vendor Notes

Note Type Comments Provided By
Purity 99% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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