In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 19 | Yes |
Popular Name: N'-[(4-imidazol-1-ylphenyl)methyl]-N,N-dimethyl-propane-1,3-diamine N'-[(4-imidazol-1-ylphenyl)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) | 1.13 | 8.35 | -40 | 2 | 4 | 1 | 34 | 259.377 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.13 | 7.22 | -50.97 | 2 | 4 | 1 | 38 | 259.377 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.13 | 10.22 | -161.53 | 4 | 4 | 3 | 40 | 261.393 | 7 | ↓ |