| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 17 | Yes |
Popular Name: N1-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-4-methyl-benzene-1,3-diamine N1-[[(2S)-1-ethylpyrrolidin-2-yl…
| 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) | 2.45 | 6.19 | -32.77 | 4 | 3 | 1 | 42 | 234.367 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.45 | 4.04 | -3.25 | 3 | 3 | 0 | 41 | 233.359 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
