| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 19 | Yes |
Popular Name: 2-methyl-4-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]aniline 2-methyl-4-[(2S)-2-(3-pyridyl)py…
| 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) | 2.65 | 6.89 | -6.48 | 2 | 3 | 0 | 42 | 253.349 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 7.33 | -33.85 | 3 | 3 | 1 | 43 | 254.357 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
