UCSF

ZINC33834968

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 9 Yes

Other Names:

MFCD11226130

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) 1.02 2.5 -4.56 0 2 0 27 124.187 0
Lo Low (pH 4.5-6) 1.02 4.81 -38.44 1 2 1 28 125.195 0

Vendor Notes

Note Type Comments Provided By
Purity >96 Fluorochem

Activity (Go SEA)

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

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