UCSF

ZINC36985028

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2009 14 Yes

Popular Name: (2S)-2-methyl-3-(4-methylsulfanylanilino)propanenitrile (2S)-2-methyl-3-(4-methylsulfany…

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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) 2.76 6.26 -8.49 1 2 0 36 206.314 4 ↓

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