UCSF

ZINC02015871

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 5 No

Popular Name: Allyl methyl sulfide Allyl methyl sulfide

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CAS Number: 10152-76-8

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) 1.48 3.91 -1.9 0 0 0 0 88.175 2 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 91-93? Alfa-Aesar
Boiling_Point 91-93° Alfa-Aesar
BP 92 TCI

Activity (Go SEA)

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

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