UCSF

ZINC26496132

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 20 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) 1.49 3.12 -12.26 5 7 0 116 289.32 2
Lo Low (pH 4.5-6) 0.62 2.87 -42.05 6 7 1 115 290.328 3

Activity (Go SEA)

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