In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 15 | No |
Popular Name: N'-(2-aminoethyl)-N-[(1S)-1,2-dimethylpropyl]-N-methyl-oxamide N'-(2-aminoethyl)-N-[(1S)-1,2-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) | -0.97 | 0.85 | -48.15 | 4 | 5 | 1 | 77 | 216.305 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.79 | 0.7 | -56.62 | 3 | 5 | 0 | 83 | 215.297 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.97 | 0.34 | -5.49 | 3 | 5 | 0 | 75 | 215.297 | 5 | ↓ |