UCSF

ZINC39898615

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 35 Yes

Popular Name: (4R,6aS)-3-(5-chloro-2-hydroxy-phenyl)-4-(4-isobutoxy-3-methoxy-phenyl)-5-pentyl-4,6a-dihydropyrrolo (4R,6aS)-3-(5-chloro-2-hydroxy-p…

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Vendors

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) 6.11 11.95 -40.09 1 7 -1 91 497.015 10 ↓
Mid Mid (pH 6-8) 6.11 11.19 -14.36 2 7 0 88 498.023 10 ↓
Mid Mid (pH 6-8) 6.11 10.94 -12.02 2 7 0 88 498.023 10 ↓

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