In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 16 | Yes |
Popular Name: (2S)-1-(2-chloro-5-methyl-phenoxy)-3-(ethylamino)propan-2-ol (2S)-1-(2-chloro-5-methyl-phenox…
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) | 2.21 | 3.87 | -38.64 | 3 | 3 | 1 | 46 | 244.742 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 2.46 | -4.84 | 2 | 3 | 0 | 41 | 243.734 | 6 | ↓ |