UCSF

ZINC35276450

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2009 24 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) -0.13 2.05 -26.94 3 8 0 102 332.36 3
Hi High (pH 8-9.5) -0.13 3.27 -66.63 2 8 -1 105 331.352 3

Activity (Go SEA)

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