In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 16 | No |
Popular Name: 2-[(E)-2-phenylethenyl]-1,3-thiazolane-4-carboxylic acid 2-[(E)-2-phenylethenyl]-1,3-thia…
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CAS Number: 874509-87-2
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) | 0.59 | 6.18 | -43.58 | 1 | 3 | -1 | 52 | 234.3 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 190 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.