UCSF

ZINC38596316

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 25 No

Popular Name: (4R,7aR)-6-amino-3-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)-4,7a-dihydropyrano[2,3-c]pyrazole-5-carbo (4R,7aR)-6-amino-3-methyl-4-(6-n…

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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) 1.55 -0.96 -9.84 2 10 0 148 341.283 2 ↓
Lo Low (pH 4.5-6) 1.55 -0.57 -52.91 3 10 1 150 342.291 2 ↓

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

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