| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 20 | No |
Popular Name: 5-(4-aminophenyl)-5-methyl-2-phenyl-1,2,4-triazolan-3-one 5-(4-aminophenyl)-5-methyl-2-phe…
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CAS Number: 245039-30-9
| 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) | 2.40 | -4.52 | -10.09 | 4 | 5 | 0 | 70 | 268.32 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 197 - 200 | KeyOrganics |
| MP | 197-200° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
