In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 20 | Yes |
Popular Name: N'-tert-butyl-N-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-N-methyl-ethane-1,2-diamine N'-tert-butyl-N-[(4-methoxy-3,5-…
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) | 2.74 | 5.18 | -82.86 | 3 | 4 | 2 | 43 | 281.444 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 5.86 | -35.03 | 2 | 4 | 1 | 39 | 280.436 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 3.5 | -4.47 | 1 | 4 | 0 | 37 | 279.428 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 4.71 | -38.25 | 2 | 4 | 1 | 42 | 280.436 | 7 | ↓ |