UCSF

ZINC16669862

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2008 30 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.85 1.95 -22.26 1 8 0 104 469.61 7
Mid Mid (pH 6-8) 1.85 4.37 -53.74 2 8 1 105 470.618 7

Activity (Go SEA)

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