UCSF

ZINC20358206

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 35 Yes

Popular Name: 2-amino-N-[(4-methoxyphenyl)methyl]-1-(3-morpholinopropyl)pyrrolo[5,4-b]quinoxaline-3-carboxamide 2-amino-N-[(4-methoxyphenyl)meth…

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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 5.99 -20.75 3 9 0 108 474.565 8 ↓
Mid Mid (pH 6-8) 2.65 6.38 -33.19 4 9 1 109 475.573 8 ↓
Lo Low (pH 4.5-6) 2.65 8.66 -91.75 5 9 2 110 476.581 8 ↓

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