UCSF

ZINC03776784

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2005 18 No

Popular Name: 2-phenyl-5-(3-pyridinyl)-2,4-dihydro-3H-pyrazol-3-one 2-phenyl-5-(3-pyridinyl)-2,4-dih…

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CAS Number: 21683-61-4

Other Names:

MFCD00665192

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) 1.76 6.39 -10.73 0 4 0 46 237.262 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 192 - 194 KeyOrganics

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