UCSF

ZINC03407849

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 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) 2.71 -1.93 -27.67 2 9 0 125 487.541 6
Hi High (pH 8-9.5) 2.71 -1.38 -61.87 1 9 -1 128 486.533 6

Activity (Go SEA)

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