UCSF

ZINC19872056

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 22 Yes

Popular Name: 1-[(2R)-1-ethylpyrrolidin-2-yl]-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine 1-[(2R)-1-ethylpyrrolidin-2-yl]-…

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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) 1.92 7.68 -130.81 3 5 2 49 310.438 8 ↓
Mid Mid (pH 6-8) 1.92 6.42 -37.76 2 5 1 44 309.43 8 ↓

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