UCSF

ZINC35153899

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2009 30 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) 4.37 11.39 -21.64 1 6 0 75 422.554 8
Hi High (pH 8-9.5) 4.55 10.15 -57.06 0 6 -1 82 421.546 8

Activity (Go SEA)

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