In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 20 | Yes |
Popular Name: (1R)-N'-benzyl-N,N-dimethyl-1-(p-tolyl)ethane-1,2-diamine (1R)-N'-benzyl-N,N-dimethyl-1-(p…
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) | 3.56 | 10.56 | -33.56 | 2 | 2 | 1 | 16 | 269.412 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 8.3 | -2.72 | 1 | 2 | 0 | 15 | 268.404 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 8.77 | -40.41 | 2 | 2 | 1 | 20 | 269.412 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 11.08 | -123.03 | 3 | 2 | 2 | 21 | 270.42 | 6 | ↓ |