In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 17 | Yes |
Popular Name: 5-pyrimidinecarboxylic acid, 2-amino-4-methyl-6-(3-methyl-5-isoxazolyl)- 5-pyrimidinecarboxylic acid, 2-a…
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) | 0.26 | 4.43 | -56.38 | 2 | 7 | -1 | 118 | 233.207 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.26 | 4.87 | -53.03 | 3 | 7 | 0 | 119 | 234.215 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.