In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 20 | Yes |
Popular Name: 3-[1-[(1S)-2-cyclopropyl-1-methyl-ethyl]-4,6-dimethyl-2-oxo-pyrimidin-5-yl]propanoic 3-[1-[(1S)-2-cyclopropyl-1-methy…
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) | 1.76 | 7.8 | -48.31 | 0 | 5 | -1 | 75 | 277.344 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 8.91 | -44.72 | 1 | 5 | 0 | 76 | 278.352 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 5.82 | -18.82 | 1 | 5 | 0 | 72 | 278.352 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.