In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 24 | Yes |
Popular Name: (2R)-1-benzyloxy-3-[[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]amino]propan-2-ol (2R)-1-benzyloxy-3-[[(1S)-1-([1,…
None
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) | 1.92 | 6.73 | -53.04 | 3 | 6 | 1 | 76 | 327.408 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 5.39 | -19.28 | 2 | 6 | 0 | 72 | 326.4 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.