In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 20 | Yes |
Popular Name: N-butyl-N-[[(2S)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]butan-1-amine N-butyl-N-[[(2S)-3,4-dihydro-2H-…
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) | 4.56 | 9.39 | -37.16 | 2 | 3 | 1 | 26 | 277.432 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.56 | 7.18 | -5.08 | 1 | 3 | 0 | 24 | 276.424 | 8 | ↓ |