UCSF

ZINC36378493

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2009 12 No

Popular Name: 5-chloro-1-methyl-3-(propan-2-yl)-1H-pyrazole-4-carbaldehyde 5-chloro-1-methyl-3-(propan-2-yl…

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CAS Number: 1043918-77-9

Other Names:

MFCD11185414

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) 2.19 4.25 -7.37 0 3 0 35 186.642 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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