In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 19 | No |
Popular Name: N-[(1S)-1-(1-ethyl-4-piperidyl)ethyl]-1,1-dioxo-thian-4-amine N-[(1S)-1-(1-ethyl-4-piperidyl)e…
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) | 1.40 | 4.79 | -117.39 | 3 | 4 | 2 | 55 | 290.473 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 3.89 | -43.23 | 2 | 4 | 1 | 51 | 289.465 | 4 | ↓ |