In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | No |
Popular Name: N,N-dimethyl-1-[(5-methyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]piperidine-4-carboxamide N,N-dimethyl-1-[(5-methyl-2-thio…
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) | -0.20 | 4.58 | -16.67 | 0 | 5 | 0 | 41 | 300.453 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.20 | 6.95 | -46.41 | 1 | 5 | 1 | 43 | 301.461 | 3 | ↓ |