| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 17 | Yes |
Popular Name: (3S,4R)-N3,N4-dimethyl-N3-[(1-methylpyrazol-4-yl)methyl]tetrahydropyran-3,4-diamine (3S,4R)-N3,N4-dimethyl-N3-[(1-me…
| 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) | -0.01 | 1.78 | -41.13 | 2 | 5 | 1 | 47 | 239.343 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.01 | 0.56 | -5.65 | 1 | 5 | 0 | 42 | 238.335 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.01 | 2.51 | -38.41 | 2 | 5 | 1 | 44 | 239.343 | 4 | ↓ |
