In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 19 | Yes |
Popular Name: (1S)-1-[4-(2-chloro-5-methyl-phenoxy)-3-fluoro-phenyl]ethanamine (1S)-1-[4-(2-chloro-5-methyl-phe…
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) | 2.70 | 7.44 | -54.58 | 3 | 2 | 1 | 37 | 280.75 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 7.11 | -7.1 | 2 | 2 | 0 | 35 | 279.742 | 3 | ↓ |