In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2011 | 15 | No |
Popular Name: 4(3h)-pyrimidinone,2-chloro-3-methyl-6-(4-pyridinyl)- 4(3h)-pyrimidinone,2-chloro-3-me…
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CAS Number: 521969-44-8
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) | 1.13 | 4.68 | -7.9 | 0 | 4 | 0 | 48 | 221.647 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.13 | 5.13 | -40.64 | 1 | 4 | 1 | 49 | 222.655 | 1 | ↓ |
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