UCSF

ZINC69143549

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 19th, 2011 18 No

Popular Name: (3S)-3-[[(3R)-1,1-dioxothian-3-yl]amino]-1-ethyl-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) -0.94 -0.08 -17.1 1 6 0 84 274.342 3 ↓
Mid Mid (pH 6-8) -0.94 0.88 -66.16 2 6 1 88 275.35 3 ↓

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

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