In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 18 | No |
Popular Name: [4-[[(2R,6R)-2,6-dimethylthiomorpholin-4-yl]methyl]-2,5-dimethyl-pyrazol-3-yl]hydrazine [4-[[(2R,6R)-2,6-dimethylthiomor…
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) | 0.82 | 4.44 | -6.89 | 3 | 5 | 0 | 59 | 269.418 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.82 | 4.53 | -28.94 | 4 | 5 | 1 | 60 | 270.426 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.00 | 6.22 | -36 | 4 | 5 | 1 | 64 | 270.426 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.