In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: (1R,2S)-N1-ethyl-N1-isobutyl-1-(p-tolyl)butane-1,2-diamine (1R,2S)-N1-ethyl-N1-isobutyl-1-(…
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) | 3.61 | 6.49 | -38.81 | 3 | 2 | 1 | 31 | 263.449 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 7.66 | -31.06 | 3 | 2 | 1 | 30 | 263.449 | 7 | ↓ |