UCSF

ZINC38538662

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 14 Yes

Other Names:

MFCD18378082

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) 1.14 3.43 -44.93 3 2 1 31 191.298 2
Lo Low (pH 4.5-6) 1.14 5.29 -32.69 3 2 1 30 191.298 2
Lo Low (pH 4.5-6) 1.14 5.53 -115.71 4 2 2 32 192.306 2

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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