| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 16 | No |
Popular Name: (2S)-2-cyclopropyl-2-(methylamino)-3-(1-oxo-1,4-thiazinan-4-yl)propanenitrile (2S)-2-cyclopropyl-2-(methylamin…
| 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) | -0.30 | 1.57 | -21.79 | 1 | 4 | 0 | 56 | 241.36 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.30 | 3.15 | -52.08 | 2 | 4 | 1 | 57 | 242.368 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.30 | 1.86 | -53.76 | 2 | 4 | 1 | 61 | 242.368 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
