In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 21 | Yes |
Popular Name: (1R,2R)-1-(4-ethylphenyl)-N2-propyl-N2-(2,2,2-trifluoroethyl)propane-1,2-diamine (1R,2R)-1-(4-ethylphenyl)-N2-pro…
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) | 2.51 | 6.97 | -46.63 | 3 | 2 | 1 | 31 | 303.392 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 6.65 | -3.39 | 2 | 2 | 0 | 29 | 302.384 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.50 | 8.86 | -125.52 | 4 | 2 | 2 | 32 | 304.4 | 8 | ↓ |