In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 20 | Yes |
Popular Name: (2R)-N2-[(2-allyloxyphenyl)methyl]-N1,N1-diethyl-propane-1,2-diamine (2R)-N2-[(2-allyloxyphenyl)methy…
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) | 3.26 | 7.52 | -30.56 | 2 | 3 | 1 | 29 | 277.432 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 9.6 | -29.52 | 2 | 3 | 1 | 26 | 277.432 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.26 | 9.32 | -106.96 | 3 | 3 | 2 | 30 | 278.44 | 10 | ↓ |