In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 21 | Yes |
Popular Name: (1R)-N-[(3-chloro-4-fluoro-phenyl)methyl]-1-(1-propyl-4-piperidyl)ethanamine (1R)-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) | 4.28 | 10.78 | -108.01 | 3 | 2 | 2 | 21 | 314.876 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.28 | 9.76 | -35.07 | 2 | 2 | 1 | 16 | 313.868 | 6 | ↓ |