In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-N1-ethyl-N1-(o-tolylmethyl)-1-phenyl-propane-1,2-diamine (1S,2R)-N1-ethyl-N1-(o-tolylmeth…
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) | 3.31 | 9.1 | -105.22 | 4 | 2 | 2 | 32 | 284.447 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 8.03 | -45.3 | 3 | 2 | 1 | 31 | 283.439 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 8.79 | -29.35 | 3 | 2 | 1 | 30 | 283.439 | 6 | ↓ |