In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2010 | 9 | Yes |
Popular Name: Cyclobutanol, 1-(3-hydroxy-1-propynyl)- (9CI) Cyclobutanol, 1-(3-hydroxy-1-pro…
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CAS Number: 530158-75-9
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) | 0.38 | -0.51 | -53.13 | 1 | 2 | -1 | 43 | 125.147 | 0 | ↓ |
Lo Low (pH 4.5-6) | 0.38 | -1.06 | -6.68 | 2 | 2 | 0 | 40 | 126.155 | 0 | ↓ |