| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2005 | 11 | Yes |
Popular Name: 3-Buten-2-ol, 4-(4-pyridinyl)-, (E)- (9CI) 3-Buten-2-ol, 4-(4-pyridinyl)-, …
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CAS Number: 133080-46-3
| 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) | 1.11 | 2.32 | -5.16 | 1 | 2 | 0 | 33 | 149.193 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.11 | 2.62 | -32.65 | 2 | 2 | 1 | 34 | 150.201 | 2 | ↓ |
