In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 16 | Yes |
Popular Name: (1S)-N,N-diethyl-1-(2-methoxyphenyl)ethane-1,2-diamine (1S)-N,N-diethyl-1-(2-methoxyphe…
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) | 0.22 | 5.26 | -30.96 | 3 | 3 | 1 | 40 | 223.34 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.22 | 3.57 | -40.73 | 3 | 3 | 1 | 40 | 223.34 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.22 | 5.52 | -123.44 | 4 | 3 | 2 | 41 | 224.348 | 6 | ↓ |