| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 17 | Yes |
Popular Name: (2S)-2-(cycloheptylamino)-2-(3-methyl-2-thienyl)acetonitrile (2S)-2-(cycloheptylamino)-2-(3-m…
| 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) | 4.15 | 6.91 | -5.69 | 1 | 2 | 0 | 36 | 248.395 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.15 | 7.86 | -40.49 | 2 | 2 | 1 | 40 | 249.403 | 3 | ↓ |
