In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2008 | 29 | Yes |
Popular Name: 1-(4-fluorophenyl)-5-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]triazole-4-carboxamide 1-(4-fluorophenyl)-5-methyl-N-[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) | 2.64 | -0.18 | -42.73 | 2 | 7 | 1 | 67 | 395.462 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.