UCSF

ZINC39500047

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 29 Yes

Popular Name: (4aR)-2-[3-[[(3S)-3-hydroxy-3-phenyl-pyrrolidin-1-yl]methyl]phenyl]-4a,5,6,7-tetrahydrocyclopenta[d] (4aR)-2-[3-[[(3S)-3-hydroxy-3-ph…

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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) 2.49 6.59 -16.02 1 5 0 65 387.483 4 ↓
Lo Low (pH 4.5-6) 2.49 8.94 -45.66 2 5 1 66 388.491 4 ↓

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

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