In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2R)-N1,N2-dimethyl-1-phenyl-N2-[(1S)-1,2,2-trimethylpropyl]propane-1,2-diamine (1S,2R)-N1,N2-dimethyl-1-phenyl-…
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) | 4.07 | 8.56 | -105.19 | 3 | 2 | 2 | 21 | 264.457 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.07 | 6.77 | -37.13 | 2 | 2 | 1 | 20 | 263.449 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.07 | 6.92 | -28.55 | 2 | 2 | 1 | 16 | 263.449 | 6 | ↓ |