In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (2S)-2-[[(2R)-2-ethyl-1-piperidyl]methyl]-3,4-dihydro-2H-1,4-benzoxazine (2S)-2-[[(2R)-2-ethyl-1-piperidy…
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) | 3.46 | 7.84 | -33.46 | 2 | 3 | 1 | 26 | 261.389 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 6.32 | -4.18 | 1 | 3 | 0 | 24 | 260.381 | 3 | ↓ |