UCSF

ZINC02534640

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 24 No

Popular Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-1-(4-methylpiperazino)-2-propen-1-one (E)-3-(4,5-dimethoxy-2-nitrophen…

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CAS Number: 331461-82-6

Other Names:

MFCD00169731

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Annotations

None

Vendors

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) 1.26 1.94 -57.47 1 8 1 89 336.368 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 149 - 151 KeyOrganics

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

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