| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 21 | No |
Popular Name: 3-[isobutyl-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]amino]propanethioamide 3-[isobutyl-[(4-methoxy-3,5-dime…
| 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) | 2.08 | 6.53 | -34.01 | 3 | 4 | 1 | 53 | 310.487 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 4.91 | -9.92 | 2 | 4 | 0 | 51 | 309.479 | 8 | ↓ |
