| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 20 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-[[(3S)-1-methylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide 5-(3-aminoprop-1-ynyl)-N-[[(3S)-…
| 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) | -0.59 | 3.77 | -94.21 | 5 | 5 | 2 | 74 | 274.368 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.59 | 3.36 | -45.11 | 4 | 5 | 1 | 72 | 273.36 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
