| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2009 | 26 | No |
Popular Name: (2S)-N-(cyanomethyl)-2-(cyclohexylmethyl)-N'-[(4-methoxyphenyl)methyl]propanediamide (2S)-N-(cyanomethyl)-2-(cyclohex…
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| 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) | 2.88 | 6.62 | -13.55 | 2 | 6 | 0 | 91 | 357.454 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 4.24 | -38.12 | 1 | 6 | -1 | 98 | 356.446 | 8 | ↓ |
