| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: 2-[[(1R,2R)-2-amino-1-(5-chloro-2-thienyl)propyl]-ethyl-amino]-N,N-dimethyl-acetamide 2-[[(1R,2R)-2-amino-1-(5-chloro-…
| 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) | 1.12 | 3.92 | -50.18 | 3 | 4 | 1 | 51 | 304.867 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 3.61 | -6.21 | 2 | 4 | 0 | 50 | 303.859 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 4.91 | -32.2 | 3 | 4 | 1 | 51 | 304.867 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 5.2 | -115.88 | 4 | 4 | 2 | 52 | 305.875 | 6 | ↓ |
