UCSF

ZINC35368237

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2009 19 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) 2.77 7.25 -42.27 2 5 1 72 285.751 5
Hi High (pH 8-9.5) 2.77 6.03 -5.73 1 5 0 67 284.743 5

Activity (Go SEA)

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