UCSF

ZINC53427220

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Substance Information

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

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

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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) 1.45 3.79 -47.65 2 4 1 51 275.438 8 ↓
Mid Mid (pH 6-8) 1.45 4.94 -142.37 3 4 2 55 276.446 8 ↓

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

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