UCSF

ZINC38202569

Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2010 35 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) 4.09 9.33 -33.37 4 12 1 151 482.569 10
Hi High (pH 8-9.5) 4.09 7.35 -9.88 3 12 0 150 481.561 10

Activity (Go SEA)

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