In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: (1R)-N-(2-dimethylaminoethyl)-1-(4-ethoxyphenyl)-N-propyl-ethane-1,2-diamine (1R)-N-(2-dimethylaminoethyl)-1-…
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) | 2.07 | 5.17 | -115.92 | 4 | 4 | 2 | 45 | 295.471 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 7.12 | -107.37 | 4 | 4 | 2 | 44 | 295.471 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 2.71 | -47 | 3 | 4 | 1 | 43 | 294.463 | 10 | ↓ |