In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 17 | Yes |
Popular Name: N-[(2-isopropoxyphenyl)methyl]-N',N'-dimethyl-ethane-1,2-diamine N-[(2-isopropoxyphenyl)methyl]-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) | 2.27 | 5.07 | -35.05 | 2 | 3 | 1 | 29 | 237.367 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 6.18 | -33.71 | 2 | 3 | 1 | 26 | 237.367 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.27 | 7.61 | -108.72 | 3 | 3 | 2 | 30 | 238.375 | 7 | ↓ |