UCSF

ZINC04472576

Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2005 20 No

Other Names:

MFCD02113266

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) 4.29 1.89 -7.66 0 2 0 26 264.324 2

Vendor Notes

Note Type Comments Provided By
mp 75 - 75.5 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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