| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2010 | 12 | Yes |
Popular Name: (2S)-3-[[(1S)-3-methoxy-1-methyl-propyl]amino]-2-methyl-propanenitrile (2S)-3-[[(1S)-3-methoxy-1-methyl…
| 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) | 1.21 | 3.76 | -49.41 | 2 | 3 | 1 | 50 | 171.264 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 2.57 | -6.05 | 1 | 3 | 0 | 45 | 170.256 | 6 | ↓ |
