UCSF

ZINC69144202

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 19th, 2011 20 No

Popular Name: (2S)-1-[[(3R)-1,1-dioxothian-3-yl]amino]-3-[[(2R)-tetrahydrofuran-2-yl]methoxy]propan-2-ol (2S)-1-[[(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) -0.40 -1.18 -59.33 3 6 1 89 308.42 7 ↓
Mid Mid (pH 6-8) -0.40 -2.42 -15.81 2 6 0 85 307.412 7 ↓

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Rings

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

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