In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 17 | Yes |
Popular Name: N,N-dimethyl-N'-[1-(2,2,2-trifluoroethyl)-4-piperidyl]ethane-1,2-diamine N,N-dimethyl-N'-[1-(2,2,2-triflu…
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) | 1.47 | 2.25 | -40.54 | 2 | 3 | 1 | 23 | 254.32 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 1.08 | -3.54 | 1 | 3 | 0 | 19 | 253.312 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 4.73 | -113.81 | 3 | 3 | 2 | 24 | 255.328 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 3.55 | -35.74 | 2 | 3 | 1 | 20 | 254.32 | 6 | ↓ |