UCSF

ZINC34668620

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 21 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) 2.84 7.77 -46.88 2 4 1 37 310.849 6
Mid Mid (pH 6-8) 2.84 5.56 -8.79 1 4 0 36 309.841 6

Activity (Go SEA)

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