In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (1R)-N'-[(1R)-2-methoxy-1-methyl-ethyl]-N'-methyl-1-phenyl-ethane-1,2-diamine (1R)-N'-[(1R)-2-methoxy-1-methyl…
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) | -0.23 | 3.26 | -37.93 | 3 | 3 | 1 | 40 | 223.34 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.23 | 2.83 | -2.6 | 2 | 3 | 0 | 38 | 222.332 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.23 | 4.92 | -33.71 | 3 | 3 | 1 | 40 | 223.34 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.23 | 5.25 | -119.06 | 4 | 3 | 2 | 41 | 224.348 | 6 | ↓ |