In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 18 | Yes |
Popular Name: 2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-cyclopropyl-N-methyl-acetamide 2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-o…
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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) | 2.23 | 8.74 | -33.69 | 1 | 3 | 1 | 25 | 251.394 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 7.42 | -7.43 | 0 | 3 | 0 | 24 | 250.386 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.