| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 6th, 2011 | 22 | Yes |
Popular Name: 3-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl-[(5-methyl-2-thienyl)methyl]amino]propan-1-ol 3-[[4-(3-hydroxyprop-1-ynyl)-2-t…
| 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) | 2.29 | 6.08 | -41.83 | 3 | 3 | 1 | 45 | 336.502 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 3.6 | -10.31 | 2 | 3 | 0 | 44 | 335.494 | 7 | ↓ |
