In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | Yes |
Popular Name: (1R)-N-[[(3R)-tetrahydrofuran-3-yl]methyl]-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine (1R)-N-[[(3R)-tetrahydrofuran-3-…
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) | 1.48 | 6.05 | -50.29 | 2 | 5 | 1 | 56 | 247.322 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.48 | 4.89 | -14.95 | 1 | 5 | 0 | 51 | 246.314 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.