UCSF

ZINC34891347

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 17 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) -1.28 -1.6 -65.11 6 6 1 109 238.267 6
Hi High (pH 8-9.5) -1.28 -1.98 -19.9 5 6 0 107 237.259 6

Activity (Go SEA)

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