In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2S)-N2-cyclopropyl-N1-ethyl-N2-(2,2,2-trifluoroethyl)cycloheptane-1,2-diamine (1S,2S)-N2-cyclopropyl-N1-ethyl-…
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) | 3.69 | 7.35 | -30.62 | 2 | 2 | 1 | 20 | 279.37 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.69 | 9.06 | -103.64 | 3 | 2 | 2 | 21 | 280.378 | 6 | ↓ |