In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 20 | Yes |
Popular Name: (2S)-3-[2-methoxyethyl(methyl)amino]-2-phenyl-2-(propylamino)propan-1-ol (2S)-3-[2-methoxyethyl(methyl)am…
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) | 2.01 | 3.28 | -28.81 | 3 | 4 | 1 | 49 | 281.42 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 4 | -3.25 | 2 | 4 | 0 | 45 | 280.412 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 3.85 | -34.75 | 3 | 4 | 1 | 46 | 281.42 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 4.82 | -109.92 | 4 | 4 | 2 | 51 | 282.428 | 10 | ↓ |