UCSF

ZINC36378400

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2009 12 Yes

Popular Name: (3aS,9aS)-decahydro-1H-pyrrolo[3,4-b]indolizine (3aS,9aS)-decahydro-1H-pyrrolo[3…

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CAS Number: 1486484-43-8

Other Names:

MFCD12912736

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) 2.27 3.23 -28.46 2 2 1 16 167.276 0 ↓
Lo Low (pH 4.5-6) 2.27 4.66 -101.59 3 2 2 21 168.284 0 ↓

Vendor Notes

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

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