UCSF

ZINC00594734

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 25 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) 3.85 -1.45 -12.79 1 6 0 64 351.435 4
Mid Mid (pH 6-8) 3.85 -1.28 -29.07 2 6 1 65 352.443 4

Activity (Go SEA)

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