| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(2-pyrrolidin-1-ylphenyl)methyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(2-pyrrol…
| 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) | 3.07 | 9.85 | -34.19 | 2 | 3 | 1 | 20 | 290.475 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 9.3 | -34.84 | 2 | 3 | 1 | 23 | 290.475 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 11.38 | -117.92 | 3 | 3 | 2 | 24 | 291.483 | 8 | ↓ |
