| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2011 | 19 | Yes |
Popular Name: 4-chloro-2-[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]benzoic 4-chloro-2-[[(2S)-1-ethylpyrroli…
| 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) | 3.29 | 8.1 | -55.64 | 2 | 4 | 0 | 57 | 282.771 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 5.77 | -42.43 | 1 | 4 | -1 | 55 | 281.763 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
