In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 14 | No |
Popular Name: [(3S)-3-[(2R)-2-methyl-1-piperidyl]tetrahydrothiophen-3-yl]methanamine [(3S)-3-[(2R)-2-methyl-1-piperid…
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) | 1.10 | 3.26 | -44.8 | 3 | 2 | 1 | 31 | 215.386 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 5.21 | -115.04 | 4 | 2 | 2 | 32 | 216.394 | 2 | ↓ |