In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: (2S)-2-amino-N-[(1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)methyl]-N-methyl-butanamide (2S)-2-amino-N-[(1,3-dimethyl-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) | -1.75 | 3.89 | -51.43 | 3 | 7 | 1 | 92 | 269.325 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.75 | 3.59 | -22.09 | 2 | 7 | 0 | 90 | 268.317 | 4 | ↓ |