In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | Yes |
Popular Name: 6-[(1S)-1-aminobutyl]-4-(2-dimethylaminoethyl)-1,4-benzoxazin-3-one 6-[(1S)-1-aminobutyl]-4-(2-dimet…
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) | 0.16 | 6.03 | -114.24 | 4 | 5 | 2 | 62 | 293.411 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.16 | 3.49 | -57.96 | 3 | 5 | 1 | 60 | 292.403 | 6 | ↓ |