In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 14 | No |
Popular Name: [(3S)-3-[(3S)-3-methyl-1-piperidyl]tetrahydrothiophen-3-yl]methanamine [(3S)-3-[(3S)-3-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) | 1.01 | 3.59 | -46.16 | 3 | 2 | 1 | 31 | 215.386 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 5.28 | -123.89 | 4 | 2 | 2 | 32 | 216.394 | 2 | ↓ |