In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: N,N-diisopropyl-N'-[1-(2,2,2-trifluoroethyl)-4-piperidyl]ethane-1,2-diamine N,N-diisopropyl-N'-[1-(2,2,2-tri…
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) | 2.82 | 4.7 | -41.91 | 2 | 3 | 1 | 23 | 310.428 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.82 | 3.31 | -2.81 | 1 | 3 | 0 | 19 | 309.42 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 6.67 | -114.37 | 3 | 3 | 2 | 24 | 311.436 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 5.46 | -31.57 | 2 | 3 | 1 | 20 | 310.428 | 8 | ↓ |