UCSF

ZINC25920311

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2009 23 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.36 3.9 -38.67 4 6 1 83 320.413 5
Hi High (pH 8-9.5) 0.36 1.74 -12.73 3 6 0 82 319.405 5

Activity (Go SEA)

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