In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2011 | 24 | Yes |
Popular Name: 5-[(4-oxo-1-phenyl-5H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]pentanamide 5-[(4-oxo-1-phenyl-5H-pyrazolo[3…
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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) | 2.52 | 3.45 | -56.04 | 2 | 7 | -1 | 110 | 342.404 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.06 | 4.86 | -23.39 | 3 | 7 | 0 | 107 | 343.412 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.