In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 18 | Yes |
Popular Name: (2S)-N-[[(2S)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]-N,2-dimethyl-butan-1-amine (2S)-N-[[(2S)-3,4-dihydro-2H-1,4…
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) | 3.31 | 7.41 | -36.95 | 2 | 3 | 1 | 26 | 249.378 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 5.42 | -4.88 | 1 | 3 | 0 | 24 | 248.37 | 5 | ↓ |