UCSF

ZINC06658352

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2006 20 Yes

Popular Name: ethyl 1-phenyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylate ethyl 1-phenyl-4,5,6,7-tetrahydr…

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CAS Number: 93019-39-7

Other Names:

MFCD08277204

QA-7103

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) 3.28 2.39 -10.13 0 4 0 44 270.332 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0226624A1; US4851425 IBM Patent Data

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