In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 19 | Yes |
Popular Name: 3-chloro-2-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]aniline 3-chloro-2-[(2R)-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) | 2.85 | 7.07 | -5.99 | 2 | 3 | 0 | 42 | 273.767 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.85 | 7.69 | -29.94 | 3 | 3 | 1 | 43 | 274.775 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.