UCSF

ZINC36135344

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 21 Yes

Popular Name: N-(1-ethylpiperidin-4-yl)-N-methyl-octahydro-1H-indole-2-carboxamide N-(1-ethylpiperidin-4-yl)-N-meth…

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CAS Number: 1251923-98-4

Other Names:

MFCD13732431

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) 3.03 7.95 -82.55 3 4 2 41 295.471 3 ↓
Hi High (pH 8-9.5) 3.03 6.83 -39.08 2 4 1 37 294.463 3 ↓

Vendor Notes

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

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