In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 18 | No |
Popular Name: N-[(2S)-2-amino-2-phenyl-ethyl]-2,3-dihydro-1,4-dioxine-5-carboxamide N-[(2S)-2-amino-2-phenyl-ethyl]-…
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) | -1.35 | 2.65 | -60.25 | 4 | 5 | 1 | 75 | 249.29 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.35 | 2.21 | -12.23 | 3 | 5 | 0 | 74 | 248.282 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.