UCSF

ZINC38596452

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Substance Information

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

Popular Name: (4R,7aS)-6-amino-3-methyl-4-[5-(4-nitrophenyl)-2-furyl]-4,7a-dihydropyrano[2,3-c]pyrazole-5-carbonit (4R,7aS)-6-amino-3-methyl-4-[5-(…

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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) 2.90 2.85 -12.26 2 9 0 143 363.333 3 ↓
Lo Low (pH 4.5-6) 2.90 3.23 -54.36 3 9 1 144 364.341 3 ↓

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

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