In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 24 | Yes |
Popular Name: N'-[(2,6-dimethoxyphenyl)methyl]-N,N-dimethyl-N'-(3-pyridylmethyl)ethane-1,2-diamine N'-[(2,6-dimethoxyphenyl)methyl]…
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) | 1.95 | 6.54 | -31.35 | 1 | 5 | 1 | 39 | 330.452 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 4.41 | -7.01 | 0 | 5 | 0 | 38 | 329.444 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 6.84 | -38.51 | 1 | 5 | 1 | 39 | 330.452 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.95 | 7.31 | -84.64 | 2 | 5 | 2 | 40 | 331.46 | 9 | ↓ |