In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 16 | Yes |
Popular Name: (2S)-N2-(2-butoxyethyl)-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-(2-butoxyethyl)-N1,N1-di…
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) | 2.63 | 6.37 | -28.48 | 2 | 3 | 1 | 26 | 231.404 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 7.39 | -105.43 | 3 | 3 | 2 | 30 | 232.412 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 5.8 | -30.32 | 2 | 3 | 1 | 29 | 231.404 | 11 | ↓ |