UCSF

ZINC38338641

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2010 15 Yes

Popular Name: 1-methyl-2-phenyl-2-pyrrolidin-1-ylethylamine 1-methyl-2-phenyl-2-pyrrolidin-1…

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CAS Number: 110153-74-7

Other Names:

MFCD09040558

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) 1.53 6.33 -114.17 4 2 2 32 206.333 3 ↓
Hi High (pH 8-9.5) 1.53 4.53 -36.59 3 2 1 31 205.325 3 ↓
Mid Mid (pH 6-8) 1.53 6.01 -31.02 3 2 1 30 205.325 3 ↓

Vendor Notes

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

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