In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 14 | No |
Popular Name: 3-(3-Nitro-pyrazol-1-yl)-propionic acid methyl ester 3-(3-Nitro-pyrazol-1-yl)-propion…
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CAS Number: 1002033-59-1
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) | 0.29 | 5.6 | -12.44 | 0 | 7 | 0 | 90 | 199.166 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.