| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: 2-[[(1S,2R)-2-amino-1-(5-methyl-2-thienyl)butyl]-cyclopentyl-amino]ethanol 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) | 2.55 | 3.55 | -43.4 | 4 | 3 | 1 | 51 | 297.488 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 3.2 | -2.84 | 3 | 3 | 0 | 49 | 296.48 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 4.7 | -108.58 | 5 | 3 | 2 | 52 | 298.496 | 7 | ↓ |
