In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: (2R)-2-amino-N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-methyl-butanamide (2R)-2-amino-N-[(1S)-1-(2,3-dihy…
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) | 0.87 | 3.04 | -45.88 | 4 | 5 | 1 | 75 | 279.36 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.87 | 3.21 | -10.33 | 3 | 5 | 0 | 74 | 278.352 | 4 | ↓ |