UCSF

ZINC58323258

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 29 Yes

Popular Name: N-ethyl-2-morpholino-N-[(4-oxo-3H-quinazolin-2-yl)methyl]pyridine-3-carboxamide N-ethyl-2-morpholino-N-[(4-oxo-3…

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Download: MOL2 SDF SMILES Flexibase

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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) 0.83 7.76 -17.45 1 8 0 91 393.447 5 ↓
Hi High (pH 8-9.5) 1.29 5.05 -52.76 0 8 -1 95 392.439 5 ↓
Lo Low (pH 4.5-6) 0.83 8.22 -48.93 2 8 1 93 394.455 5 ↓

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