UCSF

ZINC27986757

Substance Information

In ZINC since Heavy atoms Benign functionality
February 22nd, 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) 0.10 0.54 -46.8 2 7 -1 108 279.203 1
Hi High (pH 8-9.5) 0.28 -1.25 -99.19 1 7 -2 114 278.195 1

Activity (Go SEA)

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