In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 20 | Yes |
Popular Name: 7-Furan-2-yl-5-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine 7-Furan-2-yl-5-phenyl-4,5,6,7-te…
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CAS Numbers: 16882-23-8 , 301320-67-2
4-Methoxy-3-methylphenylacetone
7-Furan-2-yl-5-phenyl-4,5,6,7-tetrahydro-
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) | 2.19 | 9.95 | -8.74 | 1 | 5 | 0 | 56 | 266.304 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 10.67 | -110.35 | 3 | 5 | 2 | 62 | 268.32 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.37 | 9.75 | -44.13 | 2 | 5 | 1 | 60 | 267.312 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |