UCSF

ZINC40989757

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2010 10 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) 2.49 6.63 -33.43 1 1 1 4 207.135 2
Hi High (pH 8-9.5) 2.49 4.54 -0.77 0 1 0 3 206.127 2

Activity (Go SEA)

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