In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2008 | 19 | Yes |
Popular Name: N-[(4-butoxyphenyl)methyl]-N,N',N'-trimethyl-ethane-1,2-diamine N-[(4-butoxyphenyl)methyl]-N,N',…
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) | 3.27 | 7.85 | -37.74 | 1 | 3 | 1 | 17 | 265.421 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 7.98 | -36.98 | 1 | 3 | 1 | 17 | 265.421 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.27 | 10.38 | -112.96 | 2 | 3 | 2 | 18 | 266.429 | 9 | ↓ |