UCSF

ZINC00806051

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2004 15 Yes

Popular Name: (4-Fluoro-phenyl)-pyridin-3-ylmethyl-amine (4-Fluoro-phenyl)-pyridin-3-ylme…

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CAS Number: 78675-95-3

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) 2.12 5.37 -5.58 1 2 0 25 202.232 3 ↓
Lo Low (pH 4.5-6) 2.12 5.84 -38.37 2 2 1 26 203.24 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 89 - 91 Enamine Building Blocks
MP 89...91 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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