UCSF

ZINC04171441

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 24 No

Popular Name: 5,5-dimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethylaminomethylene]cyclohexane-1,3-dione 5,5-dimethyl-2-[2-(2-methyl-1H-i…

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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) 3.21 8.22 -47.24 1 4 -1 68 323.416 4 ↓
Mid Mid (pH 6-8) 2.29 9.06 -11.52 2 4 0 62 324.424 4 ↓

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

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