UCSF

ZINC00056898

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 22 Yes

Popular Name: (R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine (R,R)-2,6-Bis(4-isopropyl-2-oxaz…

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CAS Numbers: 118949-61-4 , 131864-67-0 , 13535-01-8

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) 2.54 0.73 -9.07 0 5 0 56 301.39 4 ↓
Mid Mid (pH 6-8) 2.54 2.09 -35.04 1 5 1 58 302.398 4 ↓
Lo Low (pH 4.5-6) 2.54 3.43 -81.28 2 5 2 59 303.406 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 154 TCI
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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