UCSF

ZINC35973845

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2009 36 No

Popular Name: CEFTRIAXONE SODIUM TRIHYDRATE CEFTRIAXONE SODIUM TRIHYDRATE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 104376-79-6 , 104376-79-6, 73384-59-5 [ceftriaxone]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) -1.22 0.05 -134.42 3 15 -2 221 552.576 8 ↓

Vendor Notes

Note Type Comments Provided By
MP 236 TCI
Therapy antibacterial SMDC Pharmakon
PUBCHEM_PATENT_ID EP0347777A2; EP0347777B1; EP0791596A1 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.