UCSF

ZINC69143518

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 19th, 2011 19 No

Popular Name: (3S)-3-[[(3R)-1,1-dioxothian-3-yl]amino]-1-propyl-pyrrolidine-2,5-dione (3S)-3-[[(3R)-1,1-dioxothian-3-y…

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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) -0.44 0.68 -16.98 1 6 0 84 288.369 4 ↓
Mid Mid (pH 6-8) -0.44 1.63 -66.36 2 6 1 88 289.377 4 ↓

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

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