UCSF

ZINC26289147

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 15 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) 0.40 -1.01 -58 6 4 1 84 211.216 2
Hi High (pH 8-9.5) 0.40 -0.54 -80.33 5 4 0 87 210.208 2

Activity (Go SEA)

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