UCSF

ZINC39899330

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 33 Yes

Popular Name: (4S,6aS)-3-(5-chloro-2-hydroxy-phenyl)-4-(3-ethoxyphenyl)-5-(3-isopropoxypropyl)-4,6a-dihydropyrrolo (4S,6aS)-3-(5-chloro-2-hydroxy-p…

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Annotations

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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) 4.80 8.77 -10.75 2 7 0 88 469.969 9 ↓
Mid Mid (pH 6-8) 4.80 9.1 -12.96 2 7 0 88 469.969 9 ↓

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