UCSF

ZINC02581320

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 15 No

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) 0.66 3.77 -37.23 0 4 -1 59 207.205 4
Mid Mid (pH 6-8) 1.67 3.82 -16.65 0 4 0 53 208.213 5

Activity (Go SEA)

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