In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: N-[(2-methoxyphenyl)methyl]-N'-methyl-N-propyl-ethane-1,2-diamine N-[(2-methoxyphenyl)methyl]-N'-m…
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) | 2.41 | 4.96 | -37.62 | 2 | 3 | 1 | 29 | 237.367 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 3.52 | -3.14 | 1 | 3 | 0 | 24 | 236.359 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 5.75 | -29.76 | 2 | 3 | 1 | 26 | 237.367 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.41 | 7.2 | -105.75 | 3 | 3 | 2 | 30 | 238.375 | 8 | ↓ |