UCSF

ZINC39267155

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 32 Yes

Popular Name: (3S,6S)-3-benzyl-6-[2-[4-(3,5-dichloro-4-pyridyl)piperazin-1-yl]-2-oxo-ethyl]piperazine-2,5-dione (3S,6S)-3-benzyl-6-[2-[4-(3,5-di…

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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) 2.96 6.95 -11.59 2 8 0 95 476.364 5 ↓
Lo Low (pH 4.5-6) 2.96 7.41 -47.16 3 8 1 96 477.372 5 ↓

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

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