UCSF

ZINC19450413

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 32 Yes

Popular Name: 6-[(4-fluorophenyl)methyl]-N-(3-isopropoxypropyl)-2-(2-pyridyl)-7,8-dihydro-5H-pyrido[3,4-e]pyrimidi 6-[(4-fluorophenyl)methyl]-N-(3-…

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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) 3.75 12.27 -58.54 2 6 1 64 436.555 9 ↓
Hi High (pH 8-9.5) 3.75 9.92 -15.1 1 6 0 63 435.547 9 ↓

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

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