In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 18 | Yes |
Popular Name: (2S)-2-(4-bromo-2-chloro-phenoxy)-2-(5-chloro-2-thienyl)ethanamine (2S)-2-(4-bromo-2-chloro-phenoxy…
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) | 4.50 | 6.97 | -54.49 | 3 | 2 | 1 | 37 | 368.103 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.50 | 6.67 | -3.84 | 2 | 2 | 0 | 35 | 367.095 | 4 | ↓ |