UCSF

ZINC19446152

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 27 Yes

Popular Name: (1S)-1-isopropyl-2-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine (1S)-1-isopropyl-2-[[2-(4-methox…

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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) 3.59 10.79 -51.7 1 5 1 44 363.485 5 ↓
Mid Mid (pH 6-8) 3.59 8.65 -10.48 0 5 0 43 362.477 5 ↓

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

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