In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 32 | Yes |
Popular Name: (5S,7R)-8-benzyl-4-(cyclohexylamino)-7-methyl-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-en-2-one (5S,7R)-8-benzyl-4-(cyclohexylam…
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) | 5.60 | 12.42 | -60.79 | 2 | 5 | 1 | 49 | 431.604 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.60 | 9.24 | -17.73 | 1 | 5 | 0 | 48 | 430.596 | 5 | ↓ |