In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 13 | No |
Popular Name: 2-[2-[(2R)-2-methyl-1-piperidyl]ethylsulfanyl]ethanamine 2-[2-[(2R)-2-methyl-1-piperidyl]…
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) | 0.91 | 5.22 | -91.34 | 4 | 2 | 2 | 32 | 204.383 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.91 | 2.96 | -44.71 | 3 | 2 | 1 | 31 | 203.375 | 5 | ↓ |