UCSF

ZINC37834482

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 18 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) 1.07 5.11 -12.65 0 5 0 50 276.764 7
Lo Low (pH 4.5-6) 1.07 7.24 -49.57 1 5 1 51 277.772 7

Activity (Go SEA)

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