UCSF

ZINC27019559

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2009 34 No

Download: MOL2 SDF SMILES Flexibase

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) 5.91 14.4 -21.21 0 5 0 63 470.594 6
Lo Low (pH 4.5-6) 5.91 15.32 -35.66 1 5 1 65 471.602 6

Activity (Go SEA)

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