UCSF

ZINC00974871

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 26 No

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) 5.35 0.57 -11.8 1 5 0 74 341.37 4
Mid Mid (pH 6-8) 5.35 0.73 -42.43 1 5 1 74 341.37 4

Vendor Notes

Note Type Comments Provided By
mp 243 - 246 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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