UCSF

ZINC35639912

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 35 Yes

Popular Name: (3R)-N-(2-dimethylaminoethyl)-4-(2-methylbenzoyl)-8-[2-(2-thienyl)acetyl]-1-oxa-4,8-diazaspiro[4.5]d (3R)-N-(2-dimethylaminoethyl)-4-…

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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) 1.78 8.48 -57.02 2 8 1 83 499.657 7 ↓
Hi High (pH 8-9.5) 1.96 6.29 -37.23 1 8 0 90 498.649 7 ↓

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

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