UCSF

ZINC33595870

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2009 39 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) 5.01 13.73 -18.4 1 6 0 65 523.608 10
Lo Low (pH 4.5-6) 5.01 14.17 -52.76 2 6 1 67 524.616 10

Activity (Go SEA)

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