UCSF

ZINC34380766

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 12 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) -3.49 -5.88 -10.85 3 6 0 96 176.124 0
Hi High (pH 8-9.5) -3.49 -5.34 -48.79 2 6 -1 99 175.116 0

Activity (Go SEA)

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