UCSF

ZINC20149634

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 35 Yes

Popular Name: 2-amino-N-[2-(4-methoxyphenyl)ethyl]-1-(2-morpholinoethyl)pyrrolo[5,4-b]quinoxaline-3-carboxamide 2-amino-N-[2-(4-methoxyphenyl)et…

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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) 2.78 6 -21.08 3 9 0 108 474.565 8 ↓
Mid Mid (pH 6-8) 2.78 6.39 -35.2 4 9 1 109 475.573 8 ↓
Lo Low (pH 4.5-6) 2.78 8.66 -99.69 5 9 2 110 476.581 8 ↓

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