In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: (3R)-1-[(3-chloro-4-fluoro-phenyl)methyl]-N-propyl-pyrrolidin-3-amine (3R)-1-[(3-chloro-4-fluoro-pheny…
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 | 7.46 | -42.41 | 2 | 2 | 1 | 16 | 271.787 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 8.65 | -123.92 | 3 | 2 | 2 | 21 | 272.795 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 6.3 | -43.38 | 2 | 2 | 1 | 20 | 271.787 | 5 | ↓ |