UCSF

ZINC23944239

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 31 Yes

Popular Name: 4-(4-chlorophenyl)sulfonyl-N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[5,4-c]pyridin-2-yl)butan 4-(4-chlorophenyl)sulfonyl-N-(3-…

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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) 3.88 8.23 -55.32 3 6 1 104 481.063 6 ↓
Hi High (pH 8-9.5) 3.88 7.18 -19.54 2 6 0 99 480.055 6 ↓

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

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