In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 17th, 2004 | 18 | No |
Popular Name: 3,5-Dimethyl-1-(3-methyl-benzyl)-4-nitro-1H-pyrazole 3,5-Dimethyl-1-(3-methyl-benzyl)…
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CAS Numbers: , 956961-96-9
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) | 2.74 | 2.59 | -8.61 | 0 | 5 | 0 | 63 | 245.282 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.