| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 12 | Yes |
Popular Name: Cyclopropanecarboxylic acid, 1-cyano-2-(1-methylethyl)-, methyl ester (9CI) Cyclopropanecarboxylic acid, 1-c…
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CAS Numbers: 111735-81-0 , 724773-45-9
| 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) | 1.76 | 5.62 | -6.37 | 0 | 3 | 0 | 50 | 167.208 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.