UCSF

ZINC67946153

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 25 Yes

Popular Name: 3-[2-(dimethylamino)-5,6-dimethyl-pyrimidin-4-yl]-9-methyl-3,9-diazaspiro[5.6]dodecan-10-one 3-[2-(dimethylamino)-5,6-dimethy…

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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) 2.51 11.22 -12.43 0 6 0 53 345.491 2 ↓
Lo Low (pH 4.5-6) 2.51 11.53 -33.72 1 6 1 54 346.499 2 ↓
Lo Low (pH 4.5-6) 2.51 11.54 -33.32 1 6 1 54 346.499 2 ↓

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Rings

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

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