UCSF

ZINC22754905

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 37 No

Popular Name: 2-[4-[(4R)-6-amino-5-cyano-3-(4-isopropoxyphenyl)-1,4-dihydropyrano[5,6-d]pyrazol-4-yl]-3-phenyl-pyr 2-[4-[(4R)-6-amino-5-cyano-3-(4-…

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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) 2.47 3.88 -27.41 5 10 0 158 495.543 7 ↓
Lo Low (pH 4.5-6) 2.47 4.2 -71.78 6 10 1 160 496.551 7 ↓

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

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