In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 22 | No |
Popular Name: 8-tert-amyl-3-phenyl-3,4-diaza-1-azoniaspiro[4.5]dec-1-ene-2-thiolate 8-tert-amyl-3-phenyl-3,4-diaza-1…
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) | 5.25 | 9.54 | -10.08 | 2 | 3 | 0 | 27 | 317.502 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.25 | 9.96 | -44.42 | 3 | 3 | 1 | 32 | 318.51 | 3 | ↓ |