In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 20 | Yes |
Popular Name: (1S,5R)-3-[(4-chlorophenyl)methyl]-7-isopropyl-3,7-diazabicyclo[3.3.1]nonane (1S,5R)-3-[(4-chlorophenyl)methy…
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) | 3.86 | 11.36 | -32.51 | 1 | 2 | 1 | 8 | 293.862 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.86 | 11.6 | -27.34 | 1 | 2 | 1 | 8 | 293.862 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 11.72 | -104 | 2 | 2 | 0 | 9 | 294.87 | 3 | ↓ |