In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2007 | 34 | Yes |
Popular Name: N-[[5-(benzylcarbamoylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide N-[[5-(benzylcarbamoylmethylsulf…
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) | 3.28 | 12.24 | -14.75 | 2 | 7 | 0 | 89 | 471.586 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.53 | 8.67 | -38.49 | 3 | 7 | 1 | 98 | 472.594 | 9 | ↓ |