UCSF

ZINC63730752

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 26 No

Popular Name: 4-(3-methoxypropyl)-2-[[methyl(propyl)amino]methyl]-1-thioxo-[1,2,4]triazolo[4,3-a]quinazolin-5-one 4-(3-methoxypropyl)-2-[[methyl(p…

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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) 2.09 13.66 -41.17 1 7 1 58 376.506 8 ↓
Hi High (pH 8-9.5) 2.09 11.18 -10.66 0 7 0 57 375.498 8 ↓

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

No pre-computed analogs available. Try a structural similarity search.