UCSF

ZINC12004329

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 28 Yes

Popular Name: 1-[4-[(5S)-7-[(4-fluorophenyl)methyl]3,7-diazaspiro[4.5]decane-3-carbonyl]-2-thienyl]ethanone 1-[4-[(5S)-7-[(4-fluorophenyl)me…

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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) 2.83 11.36 -74.73 1 4 1 42 401.527 4 ↓
Hi High (pH 8-9.5) 2.83 9.19 -18.31 0 4 0 41 400.519 4 ↓

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

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