In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 20 | No |
Popular Name: (12-Phosphonododecyl)phosphonic acid (12-Phosphonododecyl)phosphonic …
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CAS Number: [7450-59-1]
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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) | 2.38 | 4.47 | -84.41 | 2 | 6 | -2 | 121 | 328.282 | 13 | ↓ |
Hi High (pH 8-9.5) | 2.38 | 6.7 | -275.44 | 0 | 6 | -4 | 126 | 326.266 | 13 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 5.59 | -176.66 | 1 | 6 | -3 | 124 | 327.274 | 13 | ↓ |