UCSF

ZINC03641584

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 18 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) 2.09 7.62 -40.15 1 4 1 31 246.334 5
Hi High (pH 8-9.5) 2.09 5.07 -8.69 0 4 0 30 245.326 5

Activity (Go SEA)

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