UCSF

ZINC00803748

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 25 Yes

Popular Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro[1,6]naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide 2-[(3-cyano-6-methyl-5,6,7,8-tet…

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CAS Number: 496018-60-1

Other Names:

MFCD02950134

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Annotations

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Vendors

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 1.02 -61 2 5 1 70 357.434 4 ↓
Lo Low (pH 4.5-6) 2.54 1.13 -131.15 3 5 2 71 358.442 4 ↓

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

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