UCSF

ZINC00740030

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 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) 5.11 11.98 -11.8 2 6 0 65 470.617 7
Lo Low (pH 4.5-6) 5.11 13.56 -47.33 3 6 1 66 471.625 7

Activity (Go SEA)

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