UCSF

ZINC07952274

Substance Information

In ZINC since Heavy atoms Benign functionality
June 26th, 2006 20 Yes

Other Names:

MFCD08443677

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) 2.48 5.78 -9.41 1 4 0 56 270.284 2
Hi High (pH 8-9.5) 2.48 6.54 -47.05 0 4 -1 59 269.276 2

Activity (Go SEA)

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