UCSF

ZINC34477857

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 35 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) 0.70 6.55 -103.55 5 9 2 104 485.629 0
Hi High (pH 8-9.5) 0.70 5.23 -47.63 4 9 1 100 484.621 0

Activity (Go SEA)

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