In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 15 | Yes |
Popular Name: N'-[(4-chlorophenyl)methyl]-N,N,N'-trimethyl-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) | 2.45 | 6.53 | -39.39 | 1 | 2 | 1 | 8 | 227.759 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 4.04 | -2.23 | 0 | 2 | 0 | 6 | 226.751 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.45 | 6.67 | -36.91 | 1 | 2 | 1 | 8 | 227.759 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 8.85 | -114.14 | 2 | 2 | 2 | 9 | 228.767 | 5 | ↓ |