In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 17 | No |
Popular Name: (3S)-N-methyl-1,1-dioxo-N-[2-(1-piperidyl)ethyl]thiolan-3-amine (3S)-N-methyl-1,1-dioxo-N-[2-(1-…
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) | 0.80 | 2.65 | -47.98 | 1 | 4 | 1 | 42 | 261.411 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 0.44 | -10.43 | 0 | 4 | 0 | 41 | 260.403 | 4 | ↓ |