UCSF

ZINC49553055

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 34 Yes

Popular Name: N-[3-[(4aR,7aR)-4-hydroxy-2-oxo-1-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-3-yl]-1,1-diox N-[3-[(4aR,7aR)-4-hydroxy-2-oxo-…

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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) 2.32 3.51 -105.63 1 10 -2 150 500.558 4 ↓
Mid Mid (pH 6-8) 2.32 3.46 -53.48 2 10 -1 148 501.566 4 ↓

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

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