In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 17 | Yes |
Popular Name: cis-3-Hydroxy-2-phenyl-3a,4,5,6,7,7a-hexahydroinden-1-one cis-3-Hydroxy-2-phenyl-3a,4,5,6,…
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CAS Number: 871482-77-8
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) | 2.73 | 8.21 | -7.18 | 0 | 2 | 0 | 34 | 228.291 | 1 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 7.31 | -43.35 | 0 | 2 | -1 | 40 | 227.283 | 1 | ↓ |