| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 18 | No |
Popular Name: (5Z)-1-allyl-5-[[(2R)-2H-pyrrol-2-yl]methylene]hexahydropyrimidine-2,4,6-trione (5Z)-1-allyl-5-[[(2R)-2H-pyrrol-…
| 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) | 0.10 | -1.29 | -44.07 | 0 | 6 | -1 | 87 | 244.23 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.36 | 1.3 | -7.7 | 1 | 6 | 0 | 84 | 245.238 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.36 | 2.29 | -40.5 | 2 | 6 | 1 | 86 | 246.246 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.10 | -0.18 | -54.23 | 1 | 6 | 0 | 89 | 245.238 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
