In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1R)-N-ethyl-N'-isopropyl-1-(o-tolyl)-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine (1R)-N-ethyl-N'-isopropyl-1-(o-t…
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) | 4.09 | 8.24 | -33.39 | 2 | 2 | 1 | 20 | 303.392 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.09 | 7.69 | -3.23 | 1 | 2 | 0 | 15 | 302.384 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.08 | 9.68 | -111.48 | 3 | 2 | 2 | 21 | 304.4 | 8 | ↓ |