| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 17th, 2005 | 17 | No |
Popular Name: 2-Benzo[d]1,3-dioxolen-5-yl-1,3-thiazolidine-4-carboxylic acid 2-Benzo[d]1,3-dioxolen-5-yl-1,3-…
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CAS Numbers: , 72678-96-7 , 948052-43-5
(4R)-2-(1,3-benzodioxol-5-yl)-1,3-thiazolidine-4-carboxylic acid
(R)-2-Benzo[1,3]dioxol-5-yl-thiazolidine-4-carboxylic acid
2-(1,3-benzodioxol-5-yl)-1,3-thiazolane-4-carboxylic acid
2-(1,3-benzodioxol-5-yl)-1,3-thiazolidine-4-carboxylic acid
2-Benzo[1,3]dioxol-5-yl-thiazolidine-4-carboxylic acid
2-Benzo[d]1,3-dioxolen-5-yl-1,3-thiazolidine-4-
2-Benzo[d]1,3-dioxolen-5-yl-1,3-thiazolidine-4-carboxylicacid
| 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) | -0.28 | 4.63 | -30.41 | 2 | 5 | 0 | 75 | 253.279 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.28 | 3.88 | -39.73 | 1 | 5 | -1 | 71 | 252.271 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 175 - 176 | KeyOrganics |
| MP | 182-184° | Oakwood Chemical |
No pre-computed analogs available. Try a structural similarity search.