In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 15 | No |
Popular Name: 4-Cyclopropyl-6-difluoromethyl-2-mercapto-nicotinonitrile 4-Cyclopropyl-6-difluoromethyl-2…
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CAS Number: 832741-18-1
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) | 2.41 | 1.21 | -46.44 | 0 | 2 | -1 | 37 | 225.243 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.41 | 1.28 | -25.49 | 1 | 2 | 0 | 38 | 226.251 | 2 | ↓ |