In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 27 | Yes |
Popular Name: N-[3-(3-pyridyl)propyl]-4-([1,2,4]triazolo[4,3-a]pyrimidin-3-yl)benzamide N-[3-(3-pyridyl)propyl]-4-([1,2,…
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) | 2.24 | 10.74 | -27.84 | 1 | 7 | 0 | 85 | 358.405 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.24 | 11.21 | -61.84 | 2 | 7 | 1 | 86 | 359.413 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.