UCSF

ZINC69181626

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2011 26 No

Popular Name: N-(3-morpholinopropyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide N-(3-morpholinopropyl)-2-pyrrol-…

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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) 2.37 6.86 -10.47 1 5 0 47 391.562 6 ↓
Mid Mid (pH 6-8) 2.37 9.14 -45.27 2 5 1 48 392.57 6 ↓

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

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