| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (1S,2R)-N1-(2-dimethylaminoethyl)-1-(3-methyl-2-thienyl)-N1-propyl-butane-1,2-diamine (1S,2R)-N1-(2-dimethylaminoethyl…
| 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) | 2.85 | 6.88 | -105.4 | 4 | 3 | 2 | 35 | 299.528 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.85 | 6.5 | -34.76 | 3 | 3 | 1 | 34 | 298.52 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.85 | 4.4 | -40.86 | 3 | 3 | 1 | 34 | 298.52 | 9 | ↓ |
