In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2008 | 11 | No |
Popular Name: 4-AMINO-2,6-DIHYDROXY-5-NITROSOPYRIMIDINE 4-AMINO-2,6-DIHYDROXY-5-NITROSOP…
Find On: PubMed — Wikipedia — Google
CAS Number: 5442-24-0
2,4(1H,3H)-Pyrimidinedione,6-amino-5-nitroso-
5-Hydroxyimino-6-iminohydrouracil; Hydrouracil, 5-hydroxyimino-6-imino-; LS-77319
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) | -0.79 | -3.95 | -34.73 | 3 | 7 | -1 | 124 | 155.093 | 1 | ↓ |
Hi High (pH 8-9.5) | -1.59 | -4.76 | -93.92 | 2 | 7 | -2 | 128 | 154.085 | 1 | ↓ |
Hi High (pH 8-9.5) | -1.59 | -4.7 | -93.38 | 2 | 7 | -2 | 128 | 154.085 | 1 | ↓ |
Hi High (pH 8-9.5) | -1.80 | -6.95 | -207.35 | 1 | 7 | -3 | 131 | 153.077 | 0 | ↓ |
Lo Low (pH 4.5-6) | -1.25 | -3.8 | -31.6 | 4 | 7 | 0 | 121 | 156.101 | 1 | ↓ |