In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: N',N'-dimethyl-N-[1-(3-methylbut-2-enyl)-4-piperidyl]butane-1,4-diamine N',N'-dimethyl-N-[1-(3-methylbut…
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) | 2.77 | 8.81 | -75.96 | 3 | 3 | 2 | 21 | 269.477 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 7.73 | -93.93 | 3 | 3 | 2 | 24 | 269.477 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 9.99 | -171.51 | 4 | 3 | 3 | 25 | 270.485 | 8 | ↓ |