In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 17 | Yes |
Popular Name: (1S)-N'-[(1R,2R)-1,2-dimethylbutyl]-1-(2-furyl)-N,N-dimethyl-ethane-1,2-diamine (1S)-N'-[(1R,2R)-1,2-dimethylbut…
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) | 2.92 | 5.74 | -35.22 | 2 | 3 | 1 | 33 | 239.383 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 4.79 | -1.98 | 1 | 3 | 0 | 28 | 238.375 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 6.78 | -34.17 | 2 | 3 | 1 | 30 | 239.383 | 7 | ↓ |