| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2009 | 15 | Yes |
Popular Name: (2S)-2-[[(1R)-1-methylpropyl]amino]-2-(m-tolyl)acetonitrile (2S)-2-[[(1R)-1-methylpropyl]ami…
| 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) | 3.10 | 6.74 | -5.38 | 1 | 2 | 0 | 36 | 202.301 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 7.49 | -40.88 | 2 | 2 | 1 | 40 | 203.309 | 4 | ↓ |
