In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 19 | Yes |
Popular Name: (1S)-2-(3-chloro-4-methoxy-anilino)-1-(4-pyridyl)ethanol (1S)-2-(3-chloro-4-methoxy-anili…
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) | 1.98 | 2.67 | -9.54 | 2 | 4 | 0 | 54 | 278.739 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 3.1 | -43.43 | 3 | 4 | 1 | 56 | 279.747 | 5 | ↓ |