In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 14 | Yes |
Popular Name: 9-amino-3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonane-9-carbonitrile 9-amino-3,7-dimethyl-3,7-diazabi…
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) | 0.09 | 3.19 | -32.83 | 3 | 4 | 1 | 57 | 195.29 | 0 | ↓ |
Hi High (pH 8-9.5) | 0.09 | 0.94 | -5.03 | 2 | 4 | 0 | 56 | 194.282 | 0 | ↓ |