UCSF

ZINC01382088

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 19 Yes

Popular Name: 3-(dimethylamino)-6-fluoropyrido[1,2-a][1,3]benzimidazole-4-carbonitrile 3-(dimethylamino)-6-fluoropyrido…

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CAS Number: 338773-88-9

Other Names:

MFCD01314705

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) 2.66 1.88 -22.38 0 4 0 44 254.268 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 318 - 320 KeyOrganics

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Rings

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

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