UCSF

ZINC07210575

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2006 26 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) 2.51 7.12 -14.25 2 6 0 85 348.406 5
Hi High (pH 8-9.5) 2.70 5.39 -51.88 1 6 -1 92 347.398 5

Activity (Go SEA)

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