In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 19 | Yes |
Popular Name: (1S)-2-amino-1-[4-(4-chloro-2-methyl-phenoxy)phenyl]ethanol (1S)-2-amino-1-[4-(4-chloro-2-me…
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) | 2.74 | 4.32 | -53.77 | 4 | 3 | 1 | 57 | 278.759 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 3.95 | -6.17 | 3 | 3 | 0 | 55 | 277.751 | 4 | ↓ |