| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 21 | Yes |
Popular Name: 2-[[(1S,2R)-2-amino-1-(5-methyl-2-thienyl)butyl]-cyclopentyl-amino]acetamide 2-[[(1S,2R)-2-amino-1-(5-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) | 1.92 | 4.35 | -107.18 | 6 | 4 | 2 | 75 | 311.495 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 2.49 | -7.15 | 4 | 4 | 0 | 72 | 309.479 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 2.85 | -42.22 | 5 | 4 | 1 | 74 | 310.487 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 3.98 | -34.77 | 5 | 4 | 1 | 74 | 310.487 | 7 | ↓ |
