In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-N2-(2-methoxyethyl)-N1,N2-dimethyl-1-(p-tolyl)propane-1,2-diamine (1S,2R)-N2-(2-methoxyethyl)-N1,N…
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) | 2.47 | 7.07 | -105.15 | 3 | 3 | 2 | 30 | 252.402 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 4.9 | -39.02 | 2 | 3 | 1 | 29 | 251.394 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 3.79 | -3.96 | 1 | 3 | 0 | 24 | 250.386 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 5.37 | -29.83 | 2 | 3 | 1 | 26 | 251.394 | 7 | ↓ |