| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 14 | Yes |
Popular Name: (2S)-2-methyl-3-[methyl-[(2-methyl-3-furyl)methyl]amino]propanenitrile (2S)-2-methyl-3-[methyl-[(2-meth…
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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) | 1.44 | 6.95 | -43.64 | 1 | 3 | 1 | 41 | 193.27 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 4.86 | -8.35 | 0 | 3 | 0 | 40 | 192.262 | 4 | ↓ |
