UCSF

ZINC12402099

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2008 38 No

Popular Name: 2-[4-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxo-butyl]isoindoli 2-[4-[2-[2-(3,4-dimethoxyphenyl)…

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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) 3.72 -0.2 -20.15 0 8 0 104 518.61 10 ↓
Mid Mid (pH 6-8) 3.72 1.53 -47.15 1 8 1 106 519.618 10 ↓

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

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