UCSF

ZINC00663175

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 25 Yes

Popular Name: 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide 2-[(3-cyano-6,7,8,9-tetrahydro-5…

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CAS Number: 332393-88-1

Other Names:

MFCD01629736

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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) 4.21 0.82 -13.8 1 4 0 65 355.438 4 ↓
Lo Low (pH 4.5-6) 4.21 0.96 -49.28 2 4 1 67 356.446 4 ↓

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