In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 20 | Yes |
Popular Name: (1S)-2-(4-chloro-3,5-dimethyl-phenoxy)-1-(4-chlorophenyl)ethanamine (1S)-2-(4-chloro-3,5-dimethyl-ph…
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) | 3.22 | 8.14 | -52.81 | 3 | 2 | 1 | 37 | 311.232 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.22 | 7.86 | -3.48 | 2 | 2 | 0 | 35 | 310.224 | 4 | ↓ |