| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 19 | No |
Popular Name: N-(3-morpholinopropyl)-2-thioxo-1H-pyridine-3-carboxamide N-(3-morpholinopropyl)-2-thioxo-…
| 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) | 0.72 | 1.59 | -60.35 | 1 | 5 | -1 | 54 | 280.373 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 3.86 | -83.06 | 2 | 5 | 0 | 56 | 281.381 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | 1.94 | -36.36 | 2 | 5 | 0 | 57 | 281.381 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.00 | 4.21 | -71.97 | 3 | 5 | 1 | 59 | 282.389 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
