| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 16 | No |
Popular Name: (2S)-2-cyclopropyl-2-(cyclopropylamino)-3-[(1R)-1-methylpropyl]sulfanyl-propanenitrile (2S)-2-cyclopropyl-2-(cyclopropy…
| 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) | 2.94 | 6.86 | -3.47 | 1 | 2 | 0 | 36 | 238.4 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 8.03 | -33.04 | 2 | 2 | 1 | 40 | 239.408 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
