In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2004 | 34 | No |
Popular Name: 1-[[5-[(2-methylbenzyl)thio]-4-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]-3-phenyl-urea 1-[[5-[(2-methylbenzyl)thio]-4-(…
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) | 4.62 | 13.7 | -17 | 2 | 9 | 0 | 118 | 474.546 | 8 | ↓ |