| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 18 | Yes |
Popular Name: 2-Benzyl-5,6-dihydroxypyrimidine-4-carboxylic acid 2-Benzyl-5,6-dihydroxypyrimidine…
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CAS Number: 878649-59-3
| 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) | 1.26 | 4.5 | -56.65 | 2 | 6 | -1 | 106 | 245.214 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 1.1 | -112.68 | 1 | 6 | -2 | 109 | 244.206 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| RNH1-1-E | Ribonuclease H1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 2100 | 0.44 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| RNH1_HUMAN | O60930 | Ribonuclease H1, Human | 2100 | 0.44 | Binding ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.
