| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 19 | No |
Popular Name: 3-[ethyl-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]amino]propanethioamide 3-[ethyl-[(4-methoxy-3,5-dimethy…
| 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) | 1.33 | 4.32 | -34.25 | 3 | 4 | 1 | 53 | 282.433 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 3.79 | -11.68 | 2 | 4 | 0 | 51 | 281.425 | 7 | ↓ |
