In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 20 | Yes |
Popular Name: (1R)-N'-(2-methoxyethyl)-N'-[(1S)-2-methoxy-1-methyl-ethyl]-1-(p-tolyl)ethane-1,2-diamine (1R)-N'-(2-methoxyethyl)-N'-[(1S…
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) | 0.20 | 4.3 | -42.48 | 3 | 4 | 1 | 49 | 281.42 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.20 | 3.9 | -3.19 | 2 | 4 | 0 | 48 | 280.412 | 9 | ↓ |
Lo Low (pH 4.5-6) | 0.20 | 6.82 | -124.71 | 4 | 4 | 2 | 51 | 282.428 | 9 | ↓ |