UCSF

ZINC04578497

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2005 14 Yes

Other Names:

MFCD00020987

MFCD03938945

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) 2.36 2.91 -31.15 1 3 1 30 200.302 4

Activity (Go SEA)

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