In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 31 | Yes |
Popular Name: 1,3,6-trimethyl-N-[3-(2-pyridylmethylcarbamoyl)phenyl]pyrazolo[3,4-b]pyridine-4-carboxamide 1,3,6-trimethyl-N-[3-(2-pyridylm…
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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) | 1.67 | 6.98 | -23.34 | 2 | 8 | 0 | 102 | 414.469 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.67 | 7.39 | -51.58 | 3 | 8 | 1 | 103 | 415.477 | 5 | ↓ |