In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 17 | Yes |
Popular Name: N-methyl-2-[1-[[(2S)-tetrahydropyran-2-yl]methyl]-4-piperidyl]ethanamine N-methyl-2-[1-[[(2S)-tetrahydrop…
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) | 2.23 | 7.02 | -86.97 | 3 | 3 | 2 | 30 | 242.407 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 4.71 | -38.75 | 2 | 3 | 1 | 29 | 241.399 | 5 | ↓ |