| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2009 | 14 | Yes |
Popular Name: 2-[5-cyano-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]acetic acid 2-[5-cyano-2,4-dioxo-3,4-dihydro…
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CAS Numbers: 56673-29-1 , [56673-29-1]
(5-cyano-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetic acid
(5-Cyano-3,4-dihydro-2,4-dioxopyrimidin-1(2H)-yl)acetic acid
2-[5-cyano-2,4-dioxo-3,4-dihydro-1(2h)-pyrimidinyl]aceticacid
| 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) | -1.23 | -0.56 | -102.16 | 0 | 7 | -2 | 122 | 193.118 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 2.360000000000000e+002 - 2.390000000000000e+002 | KeyOrganics |
| melting_point | 236 - 239 | KeyOrganics |
| MP | 236-239° | Matrix Scientific |
| Purity | 97% | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.