In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 19 | Yes |
Popular Name: N1-[(2-isopropoxyphenyl)methyl]-N2,N2,2-trimethyl-propane-1,2-diamine N1-[(2-isopropoxyphenyl)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) | 3.08 | 6.45 | -31.56 | 2 | 3 | 1 | 29 | 265.421 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 7.31 | -28.86 | 2 | 3 | 1 | 26 | 265.421 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.08 | 8.64 | -105.62 | 3 | 3 | 2 | 30 | 266.429 | 7 | ↓ |