UCSF

ZINC69097399

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2011 25 Yes

Popular Name: (4R)-2-amino-5'-fluoro-7'-methyl-spiro[3H-[1,3,5]triazino[1,2-a]benzimidazole-4,3'-indoline]-2'-one (4R)-2-amino-5'-fluoro-7'-methyl…

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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) 2.01 8.05 -26.17 5 7 1 99 337.338 0 ↓
Mid Mid (pH 6-8) 2.01 8.07 -37.33 5 7 1 99 337.338 0 ↓
Mid Mid (pH 6-8) 2.01 7.57 -19.62 4 7 0 97 336.33 0 ↓

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

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