| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1R,2S)-N1-(2-dimethylaminoethyl)-N1-isobutyl-1-(3-methyl-2-thienyl)propane-1,2-diamine (1R,2S)-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) | 2.56 | 5.72 | -98.72 | 4 | 3 | 2 | 35 | 299.528 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 4.96 | -34.18 | 3 | 3 | 1 | 34 | 298.52 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 6.23 | -37.64 | 3 | 3 | 1 | 34 | 298.52 | 8 | ↓ |
