In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2010 | 18 | Yes |
Popular Name: (1S)-2-(5-chloro-2-methoxy-phenyl)-1-(4-pyridyl)ethanamine (1S)-2-(5-chloro-2-methoxy-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) | 0.60 | 5.56 | -44.99 | 3 | 3 | 1 | 50 | 263.748 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.60 | 5.26 | -5.26 | 2 | 3 | 0 | 48 | 262.74 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.60 | 5.7 | -33.93 | 3 | 3 | 1 | 49 | 263.748 | 4 | ↓ |