UCSF

ZINC02169311

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 13 Yes

Popular Name: 2-(propylthio)nicotinamide 2-(propylthio)nicotinamide

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CAS Numbers: 175135-26-9 , [175135-26-9]

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) 1.29 2.43 -11.32 2 3 0 56 196.275 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 146-148? Alfa-Aesar
Melting_Point 146-148° Alfa-Aesar

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