UCSF

ZINC16678164

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2008 28 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.00 7.22 -17.9 1 8 0 94 408.524 11
Mid Mid (pH 6-8) 2.00 7.73 -45.84 2 8 1 95 409.532 11

Activity (Go SEA)

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