UCSF

ZINC02091486

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 25 Yes

Popular Name: methyl 2-[(2-iodobenzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate methyl 2-[(2-iodobenzoyl)amino]-…

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Other Names:

MFCD03758003

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) 5.59 -0.04 -10.32 1 4 0 55 469.344 4 ↓

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

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