UCSF

ZINC16693924

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 22 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) 2.86 7.62 -22.58 1 5 0 75 336.178 2
Hi High (pH 8-9.5) 3.38 6.65 -34.84 0 5 -1 81 335.17 2

Activity (Go SEA)

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