| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-3-[[(2R)-3-(cyclopropylamino)-2-hydroxy-propyl]-methyl-amino]-2-methyl-propanenitrile (2S)-3-[[(2R)-3-(cyclopropylamin…
| 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) | 0.38 | 1.49 | -40.12 | 3 | 4 | 1 | 64 | 212.317 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.38 | 4.12 | -52.48 | 3 | 4 | 1 | 68 | 212.317 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.38 | 3.58 | -108.01 | 4 | 4 | 2 | 65 | 213.325 | 7 | ↓ |
