UCSF

ZINC28009627

Substance Information

In ZINC since Heavy atoms Benign functionality
February 23rd, 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) 1.70 8.59 -38.07 1 4 1 34 295.428 5
Hi High (pH 8-9.5) 1.70 6.01 -13.64 0 4 0 33 294.42 5

Activity (Go SEA)

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