UCSF

ZINC00600279

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 27 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) 2.00 4.27 -13.59 1 7 0 83 364.357 1
Lo Low (pH 4.5-6) 2.00 4.52 -43.75 2 7 1 84 365.365 1

Activity (Go SEA)

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