In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1R)-N'-ethyl-N'-(2-methoxyethyl)-N-methyl-1-(4-propylphenyl)ethane-1,2-diamine (1R)-N'-ethyl-N'-(2-methoxyethyl…
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) | 3.38 | 9.05 | -109.53 | 3 | 3 | 2 | 30 | 280.456 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 7.16 | -32.75 | 2 | 3 | 1 | 29 | 279.448 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 5.46 | -2.97 | 1 | 3 | 0 | 24 | 278.44 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 9.13 | -30.12 | 2 | 3 | 1 | 26 | 279.448 | 10 | ↓ |