UCSF

ZINC49792396

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2010 34 No

Popular Name: [(2S,3R,4S,5R)-3,4-dihydroxy-5-[6-hydroxy-2-[(4-nitrophenyl)methylsulfanyl]purin-9-yl]tetrahydrofura [(2S,3R,4S,5R)-3,4-dihydroxy-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) 1.00 0.71 -209.63 2 15 -3 235 512.373 8 ↓
Mid Mid (pH 6-8) 0.54 1.53 -64.77 4 15 -1 229 514.389 8 ↓
Mid Mid (pH 6-8) 1.00 -0.43 -107.66 3 15 -2 232 513.381 8 ↓

Activity (Go SEA)

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