In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2012 | 28 | No |
Popular Name: D-INS1,3,4,5-TETRAKISPHOSPHATETETRAPOTASSIUMSALT D-INS1,3,4,5-TETRAKISPHOSPHATETE…
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CAS Numbers: 135269-51-1 , 27121-72-8
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) | -5.07 | -9.39 | -452.22 | 5 | 18 | -5 | 322 | 495.032 | 8 | ↓ |
Ref Reference (pH 7) | -5.07 | -9.39 | -454.7 | 5 | 18 | -5 | 322 | 495.032 | 8 | ↓ |
Mid Mid (pH 6-8) | -5.07 | -7.1 | -804.06 | 3 | 18 | -7 | 327 | 493.016 | 8 | ↓ |
Lo Low (pH 4.5-6) | -5.07 | -10.53 | -297.19 | 6 | 18 | -4 | 319 | 496.04 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.