In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2011 | 20 | Yes |
Popular Name: (2R)-1-(2-furyl)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]propan-2-amine (2R)-1-(2-furyl)-N-[(1S)-1-([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) | 2.38 | 8.13 | -47.63 | 2 | 5 | 1 | 60 | 271.344 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 7.43 | -15.68 | 1 | 5 | 0 | 55 | 270.336 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.