In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2010 | 26 | Yes |
Popular Name: 1-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]piperidine 1-[(5-benzylsulfanyl-4-phenyl-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) | 4.06 | 14.93 | -36.76 | 1 | 4 | 1 | 35 | 365.526 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.06 | 12.64 | -8.8 | 0 | 4 | 0 | 34 | 364.518 | 6 | ↓ |