UCSF

ZINC13009086

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2008 35 Yes

Popular Name: 3,4-diethoxy-N-[2-[[(2S)-2-(4-methoxyphenyl)-2-morpholino-ethyl]amino]-2-oxo-ethyl]benzamide 3,4-diethoxy-N-[2-[[(2S)-2-(4-me…

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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) 2.65 4.88 -14.7 2 9 0 98 485.581 12 ↓
Lo Low (pH 4.5-6) 2.65 6.82 -52.31 3 9 1 100 486.589 12 ↓

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