In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: 2-[(2S)-6-[(1R)-1-aminoethyl]-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl]-N-methyl-acetamide 2-[(2S)-6-[(1R)-1-aminoethyl]-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) | -0.21 | 2.86 | -61.49 | 4 | 6 | 1 | 86 | 306.386 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.21 | 2.58 | -14.54 | 3 | 6 | 0 | 85 | 305.378 | 4 | ↓ |