In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 13 | Yes |
Popular Name: Cyclopent[b]azepine-5a,8(1H)-diol, octahydro-8-methyl- (9CI) Cyclopent[b]azepine-5a,8(1H)-dio…
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CAS Number: 81978-81-6
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) | 0.62 | -0.72 | -30.99 | 4 | 3 | 1 | 57 | 186.275 | 0 | ↓ |