In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 18 | No |
Popular Name: 5-(4-Bromo-3-nitro-pyrazol-1-ylmethyl)-furan-2-carboxylic acid 5-(4-Bromo-3-nitro-pyrazol-1-ylm…
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CAS Number: 512809-85-7
5-(4-Bromo-3-nitro-pyrazol-1-ylmethyl)-furan-2-car
5-({4-bromo-3-nitro-1H-pyrazol-1-yl}methyl)-2-furoic acid
5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid
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) | 1.87 | 1.19 | -56.41 | 0 | 8 | -1 | 116 | 315.059 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.