UCSF

ZINC35698592

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 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) 0.37 7.1 -17.29 1 5 0 58 309.416 2
Hi High (pH 8-9.5) 0.82 5.78 -49.08 0 5 -1 61 308.408 2

Activity (Go SEA)

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