UCSF

ZINC04171681

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 27 No

Popular Name: (3,4-dimethoxyphenyl)-dimethyl-BLAHdione (3,4-dimethoxyphenyl)-dimethyl-B…

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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) 1.25 -1.03 -11.97 1 10 0 104 370.369 3 ↓
Mid Mid (pH 6-8) 1.25 -0.77 -40.99 2 10 1 105 371.377 3 ↓

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Rings

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

No pre-computed analogs available. Try a structural similarity search.