UCSF

ZINC26523003

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 26 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) 5.79 12.51 -41.01 2 2 1 26 337.446 2
Hi High (pH 8-9.5) 5.79 11.58 -8.68 1 2 0 24 336.438 2

Activity (Go SEA)

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