In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | No |
Popular Name: N'-(2-aminoethyl)-N-methyl-N-(2-pyridylmethyl)oxamide N'-(2-aminoethyl)-N-methyl-N-(2-…
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) | -2.20 | -0.32 | -50.24 | 4 | 6 | 1 | 90 | 237.283 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.01 | -0.32 | -55.39 | 3 | 6 | 0 | 96 | 236.275 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.20 | -0.7 | -6.97 | 3 | 6 | 0 | 88 | 236.275 | 5 | ↓ |
Lo Low (pH 4.5-6) | -2.20 | 0.18 | -87.77 | 5 | 6 | 2 | 91 | 238.291 | 5 | ↓ |