In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2008 | 21 | Yes |
Popular Name: N'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N'-(4-pyridylmethyl)ethane-1,2-diamine N'-[(4-chlorophenyl)methyl]-N,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) | 2.56 | 8.22 | -46.21 | 1 | 3 | 1 | 21 | 304.845 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 6.08 | -4.86 | 0 | 3 | 0 | 19 | 303.837 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 8.55 | -42.95 | 1 | 3 | 1 | 21 | 304.845 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.56 | 9.02 | -88.28 | 2 | 3 | 2 | 22 | 305.853 | 7 | ↓ |