UCSF

ZINC22919976

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 32 Yes

Popular Name: [2-ethoxy-5-[[[(2R)-1-ethylpyrrolidin-2-yl]methyl-[[1-(2-methoxyethyl)-4-piperidyl]methyl]amino]meth [2-ethoxy-5-[[[(2R)-1-ethylpyrro…

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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) 3.02 9.02 -95.34 3 6 2 51 449.68 13 ↓
Hi High (pH 8-9.5) 3.02 6.63 -36.6 2 6 1 50 448.672 13 ↓
Hi High (pH 8-9.5) 3.02 7.48 -30.75 2 6 1 50 448.672 13 ↓
Mid Mid (pH 6-8) 3.02 8.71 -93.5 3 6 2 51 449.68 13 ↓
Lo Low (pH 4.5-6) 3.02 11.62 -199.43 4 6 3 52 450.688 13 ↓

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

No pre-computed analogs available. Try a structural similarity search.