In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2012 | 19 | Yes |
Popular Name: tert-butyl 7-(cyanomethyl)-1H-indole-1-carboxylate tert-butyl 7-(cyanomethyl)-1H-in…
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CAS Numbers: 597544-18-8 , [597544-18-8]
1-(Imidazo[1,2-a]pyridin-2-yl)ethanone
1-Boc-7-(cyanomethyl)-1H-indole
1H-Indole-1-carboxylic acid, 7-(cyanomethyl)-, 1,1-dimethylethyl ester
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) | 3.18 | 8.63 | -11.44 | 0 | 4 | 0 | 55 | 256.305 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.