In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 20 | Yes |
Popular Name: (1R)-1-(4-isopropylphenyl)-2-(4-pyridylmethylamino)ethanol (1R)-1-(4-isopropylphenyl)-2-(4-…
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) | 2.53 | 4.71 | -6.58 | 2 | 3 | 0 | 45 | 270.376 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 5.15 | -37.67 | 3 | 3 | 1 | 46 | 271.384 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 6.23 | -53.44 | 3 | 3 | 1 | 50 | 271.384 | 6 | ↓ |