| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: (3S)-3-(3-morpholinopropylamino)-3-phenyl-propanenitrile (3S)-3-(3-morpholinopropylamino)…
| 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 | 5.5 | -48.99 | 2 | 4 | 1 | 53 | 274.388 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.38 | 4.24 | -6.82 | 1 | 4 | 0 | 48 | 273.38 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.38 | 7.78 | -114.88 | 3 | 4 | 2 | 54 | 275.396 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.38 | 6.51 | -36.64 | 2 | 4 | 1 | 49 | 274.388 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
