In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2010 | 28 | No |
Popular Name: 5-[[(5R)-9-phenethyl-2,9-diazaspiro[4.5]decan-2-yl]methyl]-2,1,3-benzothiadiazole 5-[[(5R)-9-phenethyl-2,9-diazasp…
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) | 4.25 | 10.43 | -44.89 | 1 | 4 | 1 | 33 | 393.58 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 8.53 | -5.94 | 0 | 4 | 0 | 32 | 392.572 | 5 | ↓ |