In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 13 | Yes |
Popular Name: 1-Methanesulfonyl-1 H -pyrazole-3-carboxylic acidmethyl ester 1-Methanesulfonyl-1 H -pyrazole-…
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CAS Number: 1005631-68-4
1-Methanesulfonyl-1 H -pyrazole-3-carboxylic acid
1-Methanesulfonyl-1H-pyrazole-3-carboxylic acid methyl ester
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) | -0.17 | 0.36 | -15.17 | 0 | 6 | 0 | 78 | 204.207 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.