| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: (2S,3R)-2-amino-3-methyl-1-[4-(thiophene-3-carbonyl)piperazin-1-yl]pentan-1-one (2S,3R)-2-amino-3-methyl-1-[4-(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) | 0.19 | 4.23 | -53.56 | 3 | 5 | 1 | 68 | 310.443 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.19 | 3.92 | -14.39 | 2 | 5 | 0 | 67 | 309.435 | 4 | ↓ |
