| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 21 | Yes |
Popular Name: N,N-dimethyl-4-[[(1S)-1-methyl-2-morpholino-ethyl]amino]pyridine-2-carboxamide N,N-dimethyl-4-[[(1S)-1-methyl-2…
| 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) | 1.27 | 2.27 | -9.59 | 1 | 6 | 0 | 58 | 292.383 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 5.05 | -46.14 | 2 | 6 | 1 | 59 | 293.391 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 2.76 | -36.67 | 2 | 6 | 1 | 59 | 293.391 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.27 | 5.05 | -98.92 | 3 | 6 | 2 | 60 | 294.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
