UCSF

ZINC58342230

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 23 Yes

Popular Name: 3-[3-(4-fluorophenyl)sulfonylpropylsulfanyl]imidazo[1,5-a]pyridine 3-[3-(4-fluorophenyl)sulfonylpro…

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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) 2.95 8.7 -15.95 0 4 0 51 350.44 6 ↓
Lo Low (pH 4.5-6) 2.95 9.18 -41.14 1 4 1 53 351.448 6 ↓

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

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