In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 21 | Yes |
Popular Name: Methyl 3-amino-5-(3-phenyl-5-isoxazyl)thiophene-2-carboxylate Methyl 3-amino-5-(3-phenyl-5-iso…
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CAS Numbers: 681260-55-9 , [681260-55-9]
Methyl 3-amino-5-(3-phenyl-5-isoxazyl)thiophene-2-
Methyl 3-amino-5-(3-phenylisoxazol-5-yl)thiophene-2-carboxylate
Methyl3-amino-5-(3-phenylisoxazol-5-yl)thiophene-2-carboxylate
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) | 3.28 | 0.64 | -8.45 | 2 | 5 | 0 | 78 | 300.339 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.