In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: (1R)-N,N-diethyl-1-phenyl-N'-[[(2R)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine (1R)-N,N-diethyl-1-phenyl-N'-[[(…
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) | 2.49 | 8.7 | -112.85 | 3 | 3 | 2 | 30 | 278.44 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.48 | 7.33 | -1.79 | 1 | 3 | 0 | 24 | 276.424 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 6.77 | -34.89 | 2 | 3 | 1 | 29 | 277.432 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 7.71 | -27.59 | 2 | 3 | 1 | 26 | 277.432 | 8 | ↓ |