| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 20 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-[[(2S)-1,4-dioxan-2-yl]methyl]pyridine-3-carboxamide 5-(3-aminoprop-1-ynyl)-N-[[(2S)-…
| 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) | -1.49 | 0.64 | -53.99 | 4 | 6 | 1 | 88 | 276.316 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.49 | 0.23 | -10.05 | 3 | 6 | 0 | 86 | 275.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
