In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 12 | Yes |
Popular Name: 2H-Pyrrolo[2,3-b]pyridin-2-one, 6-chloro-1,3-dihydro-4-hydroxy- 2H-Pyrrolo[2,3-b]pyridin-2-one, …
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CAS Number: 1190314-80-7
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) | 1.15 | 0.52 | -33.17 | 1 | 4 | -1 | 65 | 183.574 | 0 | ↓ |
Mid Mid (pH 6-8) | 1.15 | -0.26 | -8.35 | 2 | 4 | 0 | 62 | 184.582 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 2.01 | -11.83 | 2 | 4 | 0 | 62 | 184.582 | 0 | ↓ |