UCSF

ZINC23943204

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 31 No

Popular Name: [2-oxo-2-[[3-(pyrrolidin-2-ylideneamino)sulfonylphenyl]amino]ethyl] [2-oxo-2-[[3-(pyrrolidin-2-ylide…

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Download: MOL2 SDF SMILES Flexibase

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) 1.87 5.11 -30.11 3 10 0 143 441.469 7 ↓
Mid Mid (pH 6-8) 1.87 5.08 -26.97 3 10 0 143 441.469 7 ↓
Mid Mid (pH 6-8) 1.87 4.95 -26.19 3 10 0 143 441.469 7 ↓

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

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