In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 25 | Yes |
Popular Name: 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-[4-(pyrrolidin-1-ylmethyl)thiazol-2-yl]acetamide 2-(1,4-dioxa-8-azaspiro[4.5]deca…
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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) | 1.29 | 4.88 | -38.84 | 2 | 7 | 1 | 68 | 367.495 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 2.38 | -10.42 | 1 | 7 | 0 | 67 | 366.487 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 7.05 | -86.39 | 3 | 7 | 2 | 69 | 368.503 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.