In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 23 | No |
Popular Name: 6-(2-amino-1,3-thiazol-4-yl)-2-(3,5-dichlorophenyl)-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione 6-(2-amino-1,3-thiazol-4-yl)-2-(…
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CAS Number: 477854-34-5
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) | 1.99 | -1.89 | -8.76 | 2 | 7 | 0 | 95 | 370.221 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.99 | -1.81 | -32.25 | 3 | 7 | 1 | 97 | 371.229 | 2 | ↓ |
Note Type | Comments | Provided By |
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melting_point | 335 - 337 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.