In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 21 | Yes |
Popular Name: N'-[[2-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]methyl]-N,N-dimethyl-ethane-1,2-diamine N'-[[2-(2-dimethylaminoethyloxy)…
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) | 1.38 | 5.62 | -105.17 | 3 | 5 | 2 | 43 | 297.443 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 4.32 | -36.8 | 2 | 5 | 1 | 38 | 296.435 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 3.53 | -39.48 | 2 | 5 | 1 | 42 | 296.435 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 7.21 | -87.02 | 3 | 5 | 2 | 39 | 297.443 | 10 | ↓ |