| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (1R,2S)-N2-(2-dimethylaminoethyl)-N1-methyl-1-phenyl-N2-propyl-propane-1,2-diamine (1R,2S)-N2-(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) | 2.95 | 7.87 | -86.8 | 3 | 3 | 2 | 24 | 279.472 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 5.5 | -30.5 | 2 | 3 | 1 | 20 | 278.464 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 5.63 | -37.16 | 2 | 3 | 1 | 23 | 278.464 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 6.23 | -35.5 | 2 | 3 | 1 | 20 | 278.464 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.95 | 9.8 | -206.28 | 4 | 3 | 3 | 25 | 280.48 | 9 | ↓ |
