UCSF

ZINC22921705

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 15 Yes

Popular Name: cis-1-benzyloctahydropyrrolo[3,4-b]pyrrole cis-1-benzyloctahydropyrrolo[3,4…

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CAS Number: 1114985-23-7

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) 1.88 5.25 -32.68 2 2 1 16 203.309 2 ↓
Mid Mid (pH 6-8) 1.88 6.67 -108.44 3 2 2 21 204.317 2 ↓

Vendor Notes

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

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