In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | No |
Popular Name: N'-(2-aminoethyl)-N-methyl-N-[(1R)-1,2,2-trimethylpropyl]oxamide N'-(2-aminoethyl)-N-methyl-N-[(1…
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) | -0.39 | 1.01 | -48.21 | 4 | 5 | 1 | 77 | 230.332 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.21 | 0.99 | -57.13 | 3 | 5 | 0 | 83 | 229.324 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.39 | 0.62 | -5.5 | 3 | 5 | 0 | 75 | 229.324 | 5 | ↓ |