UCSF

ZINC05537765

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2006 16 Yes

Other Names:

MFCD01316268

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) 3.47 8.61 -21.69 1 2 1 17 213.304 1
Hi High (pH 8-9.5) 3.47 8.2 -8.55 0 2 0 16 212.296 1

Activity (Go SEA)

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