In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2011 | 16 | Yes |
Popular Name: (2S)-1-(2-chloro-4-fluoro-phenyl)-N-ethyl-3-methoxy-propan-2-amine (2S)-1-(2-chloro-4-fluoro-phenyl…
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) | 3.02 | 6.68 | -31.83 | 2 | 2 | 1 | 26 | 246.733 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 4.97 | -2.82 | 1 | 2 | 0 | 21 | 245.725 | 6 | ↓ |