UCSF

ZINC04167923

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 20 Yes

Popular Name: 8-Methyl-4-pyridin-4-yl-2,3,3a,4,5,9b-hexahydro-furo[3,2-c]quinoline 8-Methyl-4-pyridin-4-yl-2,3,3a,4…

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CAS Numbers: 1212329-85-5 , 1382464-64-3

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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) 2.77 6.37 -32.65 2 3 1 35 267.352 1 ↓
Mid Mid (pH 6-8) 2.77 5.91 -7 1 3 0 34 266.344 1 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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Rings

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