In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 29 | Yes |
Popular Name: 3-amino-N-[2-(propylsulfanyl)phenyl]-6-(4-pyridinyl)thieno[2,3-b]pyridine-2-carboxamide 3-amino-N-[2-(propylsulfanyl)phe…
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CAS Number: 445267-58-3
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) | 4.41 | -3.57 | -13.32 | 3 | 5 | 0 | 80 | 420.563 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.41 | -3.45 | -39.25 | 4 | 5 | 1 | 82 | 421.571 | 6 | ↓ |