UCSF

ZINC39712275

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2010 11 Yes

Other Names:

MFCD07370037

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) 1.43 4.03 -106.8 4 2 2 33 158.289 5
Mid Mid (pH 6-8) 1.43 2.79 -33.69 3 2 1 29 157.281 5
Mid Mid (pH 6-8) 1.43 2.74 -33.11 3 2 1 29 157.281 5

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem

Activity (Go SEA)

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