| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 24 | Yes |
Popular Name: (2S)-2-[(4-fluorophenyl)methyl-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl]amino]butan-1-ol (2S)-2-[(4-fluorophenyl)methyl-[…
| 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) | 2.93 | 6.62 | -42.02 | 3 | 3 | 1 | 45 | 348.463 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.93 | 4.92 | -9.26 | 2 | 3 | 0 | 44 | 347.455 | 7 | ↓ |
