UCSF

ZINC36126628

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 25 Yes

Popular Name: (3aS,5S,7aS)-3-[(4-fluorophenyl)methyl]-2-(4-piperidylamino)-3a,4,5,6,7,7a-hexahydrobenzimidazol-5-o (3aS,5S,7aS)-3-[(4-fluorophenyl)…

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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) 1.29 6.75 -100.32 5 5 2 66 348.466 4 ↓

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Rings

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

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