In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 19 | Yes |
Popular Name: (1S)-N-[(5-chloro-2-methoxy-phenyl)methyl]-1-(4-pyridyl)ethanamine (1S)-N-[(5-chloro-2-methoxy-phen…
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) | 2.83 | 6.98 | -42.92 | 2 | 3 | 1 | 39 | 277.775 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.83 | 5.83 | -4.97 | 1 | 3 | 0 | 34 | 276.767 | 5 | ↓ |