UCSF

ZINC00692666

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 33 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) 0.64 7 -14.37 0 10 0 105 461.563 10
Mid Mid (pH 6-8) 0.64 9.34 -48.89 1 10 1 106 462.571 10

Activity (Go SEA)

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