In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-N2-propyl-N2-(2,2,2-trifluoroethyl)indane-1,2-diamine (1S,2R)-N2-propyl-N2-(2,2,2-trif…
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) | 1.24 | 5.53 | -45.52 | 3 | 2 | 1 | 31 | 273.322 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.24 | 5.77 | -3.81 | 2 | 2 | 0 | 29 | 272.314 | 5 | ↓ |