In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 19 | Yes |
Popular Name: N'-[4-(4-bromo-2-chloro-phenoxy)butyl]-N,N-dimethyl-ethane-1,2-diamine N'-[4-(4-bromo-2-chloro-phenoxy)…
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) | 3.42 | 8.85 | -115.6 | 3 | 3 | 2 | 30 | 351.716 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.42 | 5.04 | -4 | 1 | 3 | 0 | 24 | 349.7 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 7.56 | -36.68 | 2 | 3 | 1 | 26 | 350.708 | 9 | ↓ |