UCSF

ZINC00734739

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 28 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) 3.41 8.77 -14.07 1 6 0 73 392.846 6
Lo Low (pH 4.5-6) 3.41 9.12 -44.52 2 6 1 74 393.854 6

Activity (Go SEA)

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