| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2009 | 14 | Yes |
Popular Name: 3-Methyl-4-(3-methylphenyl)-1H-pyrazol-5-amine 3-Methyl-4-(3-methylphenyl)-1H-p…
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CAS Numbers: , 1239130-22-3
4-(3-methyl-phenyl)-5-methyl-2H-pyr
| 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) | 2.29 | 4.8 | -5.81 | 3 | 3 | 0 | 55 | 187.246 | 1 | ↓ |
| Ref Reference (pH 7) | 2.29 | 4.75 | -6.03 | 3 | 3 | 0 | 55 | 187.246 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 4.93 | -28.7 | 4 | 3 | 1 | 56 | 188.254 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.