UCSF

ZINC19632806

Substance Information

In ZINC since Heavy atoms Benign functionality
November 5th, 2008 28 Yes

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) 2.57 6.17 -51.77 1 7 -1 108 464.679 6

Vendor Notes

Note Type Comments Provided By
mechanism Benzodiazepine receptor agonist ZereneX Building Blocks IBScreen Bioactives
biological_use Psychosedative IBScreen Bioactives IBScreen Bioactives
biological_use Sedative IBScreen Bioactives
biological_use Tranquilizer IBScreen Bioactives

Activity (Go SEA)

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