UCSF

ZINC69145033

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Substance Information

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

Popular Name: N-[(3S)-1,1-dioxothian-3-yl]thieno[3,2-c]pyridin-4-amine N-[(3S)-1,1-dioxothian-3-yl]thie…

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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) 1.58 4.01 -41.88 2 4 1 60 283.398 2 ↓
Mid Mid (pH 6-8) 1.58 3.68 -14.85 1 4 0 59 282.39 2 ↓

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

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