UCSF

ZINC20434006

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 21 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) -0.06 -0.45 -55.59 4 7 1 105 290.299 2
Hi High (pH 8-9.5) -0.06 -1.74 -19.77 3 7 0 100 289.291 2

Activity (Go SEA)

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