UCSF

ZINC16683813

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 37 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) 2.73 6.83 -15.84 1 10 0 99 513.591 11
Mid Mid (pH 6-8) 2.73 9.1 -54.43 2 10 1 100 514.599 11

Activity (Go SEA)

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