| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 18 | Yes |
Popular Name: (1S)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(4-iodophenyl)ethanamine (1S)-N-[[(2S)-1-ethylpyrrolidin-…
| 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) | 3.93 | 9.63 | -117.74 | 3 | 2 | 2 | 21 | 360.283 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 8.58 | -34.65 | 2 | 2 | 1 | 16 | 359.275 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
