| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-1-(5-chloro-2-thienyl)-N1-ethyl-N1-(2-furylmethyl)propane-1,2-diamine (1S,2R)-1-(5-chloro-2-thienyl)-N…
| 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) | 2.86 | 5.07 | -43.51 | 3 | 3 | 1 | 44 | 299.847 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 6.47 | -32.18 | 3 | 3 | 1 | 44 | 299.847 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 4.73 | -3.15 | 2 | 3 | 0 | 42 | 298.839 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.86 | 6.78 | -121.21 | 4 | 3 | 2 | 45 | 300.855 | 6 | ↓ |
