In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 20 | Yes |
Popular Name: (2R)-6-[(1S)-1-aminoethyl]-4-(2-dimethylaminoethyl)-2-methyl-1,4-benzoxazin-3-one (2R)-6-[(1S)-1-aminoethyl]-4-(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) | -0.53 | 5.29 | -107.11 | 4 | 5 | 2 | 62 | 279.384 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.53 | 2.75 | -55.97 | 3 | 5 | 1 | 60 | 278.376 | 4 | ↓ |