In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 13 | Yes |
Popular Name: 2-Azabicyclo[2.2.1]heptane, 3-(1-pyrrolidinylmethyl)-, (1S,3R,4R)- (9CI) 2-Azabicyclo[2.2.1]heptane, 3-(1…
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CAS Number: 215674-20-7
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) | 1.41 | 5.88 | -103.68 | 3 | 2 | 2 | 21 | 182.311 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 3.52 | -33.52 | 2 | 2 | 1 | 20 | 181.303 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 4.72 | -32.69 | 2 | 2 | 1 | 16 | 181.303 | 2 | ↓ |