| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2013 | 16 | Yes |
Popular Name: Carbamic acid, (6-cyano-2-pyridinyl)-, 1,1-dimethylethyl ester Carbamic acid, (6-cyano-2-pyridi…
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CAS Number: 400781-17-1
| 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 | 4.74 | -15.18 | 1 | 5 | 0 | 75 | 219.244 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 4.92 | -46.79 | 0 | 5 | -1 | 81 | 218.236 | 3 | ↓ |
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