UCSF

ZINC37839505

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 15 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) 0.09 6.05 -18.75 0 5 0 64 215.249 6
Hi High (pH 8-9.5) 0.10 5.07 -49.49 0 5 -1 70 214.241 6

Activity (Go SEA)

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