In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 20 | Yes |
Popular Name: N-[[(2S)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]-2,4,4-trimethyl-pentan-2-amine N-[[(2S)-3,4-dihydro-2H-1,4-benz…
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) | 4.22 | 7.41 | -33.85 | 3 | 3 | 1 | 38 | 277.432 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.22 | 7.14 | -3.36 | 2 | 3 | 0 | 33 | 276.424 | 5 | ↓ |