UCSF

ZINC27794804

Substance Information

In ZINC since Heavy atoms Benign functionality
February 20th, 2009 20 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) 2.42 1.1 -17.09 1 5 0 80 378.686 3
Hi High (pH 8-9.5) 2.42 0.75 -35.56 0 5 -1 82 377.678 3

Activity (Go SEA)

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