In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 13 | Yes |
Popular Name: (2R)-N2-ethyl-N1-[(1S)-2-methoxy-1-methyl-ethyl]-N1-methyl-propane-1,2-diamine (2R)-N2-ethyl-N1-[(1S)-2-methoxy…
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) | 1.15 | 2.87 | -29.77 | 2 | 3 | 1 | 29 | 189.323 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.15 | 1.8 | -1.39 | 1 | 3 | 0 | 24 | 188.315 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.15 | 3.6 | -30.46 | 2 | 3 | 1 | 26 | 189.323 | 7 | ↓ |