UCSF

ZINC26900949

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 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) 2.04 6.88 -35.49 2 5 1 54 310.805 5
Mid Mid (pH 6-8) 2.04 4.56 -9.25 1 5 0 53 309.797 5

Activity (Go SEA)

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