In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1R)-1-(3,4-dimethylphenyl)-N'-ethyl-N'-(2-methoxyethyl)-N-methyl-ethane-1,2-diamine (1R)-1-(3,4-dimethylphenyl)-N'-e…
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) | 2.90 | 8.04 | -109.16 | 3 | 3 | 2 | 30 | 266.429 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 6 | -39.22 | 2 | 3 | 1 | 29 | 265.421 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 4.42 | -3.39 | 1 | 3 | 0 | 24 | 264.413 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 6.86 | -30.09 | 2 | 3 | 1 | 26 | 265.421 | 8 | ↓ |