In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-N1-methyl-N1-(o-tolylmethyl)-1-(p-tolyl)propane-1,2-diamine (1R,2S)-N1-methyl-N1-(o-tolylmet…
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 | 9.83 | -118.7 | 4 | 2 | 2 | 32 | 284.447 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 7.36 | -44.66 | 3 | 2 | 1 | 31 | 283.439 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 9.5 | -33.34 | 3 | 2 | 1 | 30 | 283.439 | 5 | ↓ |