UCSF

ZINC04511591

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2005 17 No

Popular Name: 2,5-Dimethyl-1-phenethyl-1H-pyrrole-3-carbaldehyde 2,5-Dimethyl-1-phenethyl-1H-pyrr…

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CAS Number: 18870-81-0

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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) 2.89 2.82 -7.12 0 2 0 22 227.307 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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