In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 36 | No |
Popular Name: 7-Phenyl acetamido-3-Hydroxy-3-Cephem-4-Carboxylic acid Diphenylmethyl ester , 3-OH 7-Phenyl acetamido-3-Hydroxy-3-C…
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CAS Number: 54639-48-4
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) | 4.12 | 13.62 | -59.57 | 1 | 7 | -1 | 99 | 499.568 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 13.11 | -34.39 | 1 | 7 | 0 | 93 | 500.576 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4389524; US4477658; US4591642 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.