In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: 6-[(1S)-1-amino-2-methyl-propyl]-4-[3-(dimethylamino)propyl]-1,4-benzoxazin-3-one 6-[(1S)-1-amino-2-methyl-propyl]…
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) | 0.12 | 6.51 | -110.71 | 4 | 5 | 2 | 62 | 307.438 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.12 | 3.98 | -58.63 | 3 | 5 | 1 | 60 | 306.43 | 6 | ↓ |