In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 16 | Yes |
Popular Name: (3S)-N-[(3-chloro-4-fluoro-phenyl)methyl]piperidin-3-amine (3S)-N-[(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) | 2.09 | 4.62 | -41.59 | 3 | 2 | 1 | 29 | 243.733 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.09 | 5.81 | -124.49 | 4 | 2 | 2 | 33 | 244.741 | 3 | ↓ |