| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 13 | No |
Popular Name: 4-Chloro-5-nitro-1 H -pyrazole-3-carboxylic acid hydrazide 4-Chloro-5-nitro-1 H -pyrazole-3…
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CAS Numbers: 1046463-61-9 , 1066463-61-9
4-Chloro-5-nitro-1 H -pyrazole-3-carboxylic acid h
| 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) | -0.37 | -0.13 | -30.07 | 3 | 8 | -1 | 128 | 204.553 | 2 | ↓ |
| Ref Reference (pH 7) | -0.37 | -0.01 | -8.44 | 4 | 8 | 0 | 130 | 205.561 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.37 | -0.15 | -30.13 | 3 | 8 | -1 | 128 | 204.553 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.37 | 0.04 | -12.88 | 4 | 8 | 0 | 130 | 205.561 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.