In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 18 | Yes |
Popular Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-2-methyl-propan-2-ol 1-[2-(3,4-dimethoxyphenyl)ethyla…
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) | 1.38 | 3.69 | -53.75 | 3 | 4 | 1 | 55 | 254.35 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 2.55 | -8.67 | 2 | 4 | 0 | 51 | 253.342 | 7 | ↓ |