In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 20 | Yes |
Popular Name: (1S)-N,N-dimethyl-1-phenyl-N'-(p-tolylmethyl)ethane-1,2-diamine (1S)-N,N-dimethyl-1-phenyl-N'-(p…
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) | 3.56 | 10.38 | -34.26 | 2 | 2 | 1 | 16 | 269.412 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 8.45 | -2.6 | 1 | 2 | 0 | 15 | 268.404 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 8.71 | -38.85 | 2 | 2 | 1 | 20 | 269.412 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 11.07 | -123.75 | 3 | 2 | 2 | 21 | 270.42 | 6 | ↓ |