UCSF

ZINC01384294

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 17 Yes

Popular Name: 3-chloro-2-methyl-7-(4-pyridinyl)pyrazolo[1,5-a]pyrimidine 3-chloro-2-methyl-7-(4-pyridinyl…

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CAS Number: 439097-29-7

Other Names:

MFCD03012272

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) 1.78 6.3 -11.39 0 4 0 43 244.685 1 ↓
Lo Low (pH 4.5-6) 1.78 6.76 -45.64 1 4 1 44 245.693 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 211 - 212 KeyOrganics

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Rings

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

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