UCSF

ZINC58573971

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2011 13 Yes

Other Names:

MFCD18375326

MFCD19690038

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) 1.58 2.13 -9.19 2 3 0 48 174.203 1
Lo Low (pH 4.5-6) 1.58 2.62 -26.66 3 3 1 49 175.211 1

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.