| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2010 | 15 | Yes |
Popular Name: 3-(METHOXYCARBONYL)-1,2,2-TRIMETHYLCYCLOPENTANE-1-CARBOXYLIC ACID 3-(METHOXYCARBONYL)-1,2,2-TRIMET…
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CAS Number: 306935-15-9
| 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) | 1.97 | 6.61 | -43.68 | 0 | 4 | -1 | 66 | 213.253 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.97 | 4.69 | -6.4 | 1 | 4 | 0 | 64 | 214.261 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.