In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 20 | Yes |
Popular Name: N'-[2-(4-bromophenoxy)ethyl]-N-isopropyl-N-methyl-butane-1,4-diamine N'-[2-(4-bromophenoxy)ethyl]-N-i…
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) | 3.48 | 9.58 | -97.39 | 3 | 3 | 2 | 30 | 345.325 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.48 | 8.19 | -33.74 | 2 | 3 | 1 | 26 | 344.317 | 10 | ↓ |