In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 16 | No |
Popular Name: 4-[[(2S,6R)-2,6-dimethylthiomorpholin-4-yl]methyl]-N-methyl-thiadiazol-5-amine 4-[[(2S,6R)-2,6-dimethylthiomorp…
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) | 1.67 | 2.72 | -8.3 | 1 | 4 | 0 | 41 | 258.416 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 4.82 | -41.1 | 2 | 4 | 1 | 42 | 259.424 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.