UCSF

ZINC34227247

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2009 21 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) 3.41 8.08 -43.34 2 3 1 35 284.379 3
Hi High (pH 8-9.5) 3.41 7.15 -6.54 1 3 0 30 283.371 3

Activity (Go SEA)

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