In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | Yes |
Popular Name: 6-[(1R)-1-amino-2-methoxy-ethyl]-4-(2-dimethylaminoethyl)-1,4-benzoxazin-3-one 6-[(1R)-1-amino-2-methoxy-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) | -1.29 | 3.58 | -109.34 | 4 | 6 | 2 | 71 | 295.383 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.29 | 3.3 | -42.76 | 3 | 6 | 1 | 69 | 294.375 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.29 | 1.04 | -54.04 | 3 | 6 | 1 | 70 | 294.375 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.29 | 0.76 | -6.6 | 2 | 6 | 0 | 68 | 293.367 | 6 | ↓ |