In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 18 | Yes |
Popular Name: N-ethyl-N'-isopropyl-N-(3-phenylpropyl)ethane-1,2-diamine N-ethyl-N'-isopropyl-N-(3-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) | 3.50 | 9.98 | -111.29 | 3 | 2 | 2 | 21 | 250.43 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.50 | 8.81 | -34.88 | 2 | 2 | 1 | 16 | 249.422 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 7.83 | -36.72 | 2 | 2 | 1 | 20 | 249.422 | 9 | ↓ |