In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 19 | Yes |
Popular Name: (1S)-2-[(3-bromophenyl)methylamino]-1-(4-chlorophenyl)ethanol (1S)-2-[(3-bromophenyl)methylami…
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) | 3.77 | 5.64 | -5.35 | 2 | 2 | 0 | 32 | 340.648 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 7.05 | -50.74 | 3 | 2 | 1 | 37 | 341.656 | 5 | ↓ |