In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | No |
Popular Name: N-[[1-[(5-methyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]-4-piperidyl]methyl]acetamide N-[[1-[(5-methyl-2-thioxo-1,3,4-…
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) | 0.04 | 3.98 | -16.16 | 1 | 5 | 0 | 50 | 300.453 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.04 | 6.35 | -47.27 | 2 | 5 | 1 | 51 | 301.461 | 4 | ↓ |