UCSF

ZINC35637776

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 32 Yes

Popular Name: (3R)-N-(4-pyridylmethyl)-4-[3-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (3R)-N-(4-pyridylmethyl)-4-[3-(t…

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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) 2.79 6.8 -15.43 1 6 0 72 447.457 5 ↓
Lo Low (pH 4.5-6) 2.79 7.26 -57.65 2 6 1 73 448.465 5 ↓

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

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