UCSF

ZINC52482919

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 21 No

Popular Name: (3S)-N-[[4-[(cyclopropylamino)methyl]phenyl]methyl]-N-methyl-1,1-dioxo-thiolan-3-amine (3S)-N-[[4-[(cyclopropylamino)me…

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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) 1.19 6.38 -108.51 3 4 2 55 310.463 6 ↓
Mid Mid (pH 6-8) 1.19 4.13 -46.39 2 4 1 54 309.455 6 ↓

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

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