In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 18 | Yes |
Popular Name: N'-[(2,4-dichlorophenyl)methyl]-N,N-diethyl-N'-methyl-ethane-1,2-diamine N'-[(2,4-dichlorophenyl)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) | 3.81 | 8.45 | -35.35 | 1 | 2 | 1 | 8 | 290.258 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.81 | 6.16 | -2.07 | 0 | 2 | 0 | 6 | 289.25 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 8.43 | -34.44 | 1 | 2 | 1 | 8 | 290.258 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 10.68 | -109.3 | 2 | 2 | 2 | 9 | 291.266 | 7 | ↓ |