UCSF

ZINC69873985

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 24 Yes

Popular Name: 2-ethyl-7-[(4-imidazol-1-ylphenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 2-ethyl-7-[(4-imidazol-1-ylpheny…

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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) 1.47 11.32 -55.86 1 5 1 48 320.42 4 ↓
Mid Mid (pH 6-8) 1.47 9.05 -11.5 0 5 0 47 319.412 4 ↓
Lo Low (pH 4.5-6) 1.47 11.84 -94.03 2 5 2 49 321.428 4 ↓

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

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