UCSF

ZINC00811060

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2004 26 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) 1.22 7.6 -11.09 0 8 0 96 357.366 5
Ref Reference (pH 7) 1.22 7.6 -11.1 0 8 0 96 357.366 5
Ref Reference (pH 7) 1.22 7.83 -14.1 0 8 0 96 357.366 5
Ref Reference (pH 7) 1.22 7.92 -14.15 0 8 0 96 357.366 5

Activity (Go SEA)

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