In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 16 | No |
Popular Name: (p-Nitrobenzoyl)-malononitrile (p-Nitrobenzoyl)-malononitrile
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CAS Number: 46700-35-0
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) | 1.36 | 6.33 | -17.92 | 0 | 6 | 0 | 110 | 215.168 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 5.16 | -28.08 | 0 | 6 | -1 | 116 | 214.16 | 2 | ↓ |