In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2011 | 21 | No |
Popular Name: N-[[2-(diethylaminomethyl)phenyl]methyl]heptan-1-amine N-[[2-(diethylaminomethyl)phenyl…
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) | 4.96 | 12.43 | -105.38 | 3 | 2 | 2 | 21 | 292.511 | 12 | ↓ |
Hi High (pH 8-9.5) | 4.96 | 10.63 | -37.41 | 2 | 2 | 1 | 20 | 291.503 | 12 | ↓ |
Hi High (pH 8-9.5) | 4.96 | 11.25 | -29.54 | 2 | 2 | 1 | 16 | 291.503 | 12 | ↓ |