In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2007 | 21 | Yes |
Popular Name: [1-(4,6-dimethyl-2-pyrimidinyl)-1H-1,2,3-triazol-4-yl](2-pyridinyl)methanone [1-(4,6-dimethyl-2-pyrimidinyl)-…
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CAS Number: 923106-19-8
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 | 1.35 | -15.26 | 0 | 7 | 0 | 86 | 280.291 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 215 - 217 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.