UCSF

ZINC31816009

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 16th, 2009 26 Yes

Popular Name: N-(2-dimethylaminoethyl)-3-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxymethyl]-1,2,4-oxadiazole-5-carbox N-(2-dimethylaminoethyl)-3-[(2-o…

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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) 0.58 1.92 -52.82 3 9 1 111 360.394 7 ↓
Hi High (pH 8-9.5) 0.76 -3.21 -14.64 2 9 0 113 359.386 7 ↓
Hi High (pH 8-9.5) 0.58 -0.55 -14.92 2 9 0 110 359.386 7 ↓

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