In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2010 | 10 | Yes |
Popular Name: 3-Pyridinol, 5-ethyl-6-fluoro- (9CI) 3-Pyridinol, 5-ethyl-6-fluoro- (…
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CAS Number: 209329-03-3
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) | 2.00 | 2.43 | -16.61 | 1 | 2 | 0 | 37 | 141.145 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 1.97 | -36.99 | 0 | 2 | -1 | 36 | 140.137 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 1.2 | -6.11 | 1 | 2 | 0 | 33 | 141.145 | 1 | ↓ |