In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2005 | 21 | No |
Popular Name: C[C@]12CC[C@H](C[C@H]1CC[C@H]3[C@H]2CC[C@]4([C@@H]3CCC4=O)C)O C[C@]12CC[C@H](C[C@H]1CC[C@H]3[C…
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) | 3.43 | 0.29 | -4.99 | 1 | 2 | 0 | 37 | 290.447 | 0 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO1995002424A1 | IBM Patent Data |