In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 22 | Yes |
Popular Name: (1S)-2-(ethylamino)-1-[4-(3-isopropylphenoxy)phenyl]ethanol (1S)-2-(ethylamino)-1-[4-(3-isop…
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) | 4.18 | 7.64 | -40.87 | 3 | 3 | 1 | 46 | 300.422 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.18 | 6.15 | -6.57 | 2 | 3 | 0 | 41 | 299.414 | 7 | ↓ |