UCSF

ZINC53429148

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2010 18 No

Popular Name: N-cyclopropyl-N'-[(3R)-1,1-dioxothiolan-3-yl]-N-isobutyl-ethane-1,2-diamine N-cyclopropyl-N'-[(3R)-1,1-dioxo…

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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) 1.14 3.63 -45.4 2 4 1 51 275.438 7 ↓
Mid Mid (pH 6-8) 1.14 4.8 -141.25 3 4 2 55 276.446 7 ↓

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

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