UCSF

ZINC05175414

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2006 17 Yes

Other Names:

MFCD02295740

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) 2.96 0.87 -48.87 0 3 -1 49 229.255 5

Activity (Go SEA)

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