In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 18 | Yes |
Popular Name: (2S)-2-[(4-methyl-1-piperidyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine (2S)-2-[(4-methyl-1-piperidyl)me…
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) | 2.83 | 7.34 | -35.75 | 2 | 3 | 1 | 26 | 247.362 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.83 | 5 | -6.23 | 1 | 3 | 0 | 24 | 246.354 | 2 | ↓ |