UCSF

ZINC20419775

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 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) -1.42 1.04 -68.49 6 6 1 109 252.294 4
Hi High (pH 8-9.5) -1.42 0.73 -27.99 5 6 0 107 251.286 4

Activity (Go SEA)

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