UCSF

ZINC57956206

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2011 23 No

Popular Name: 2-[(2-chloro-4-nitro-phenoxy)methyl]pyrido[1,2-a]pyrimidin-4-one 2-[(2-chloro-4-nitro-phenoxy)met…

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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) 3.51 8.83 -17.34 0 7 0 89 331.715 4 ↓
Lo Low (pH 4.5-6) 3.51 9.37 -53.19 1 7 1 91 332.723 4 ↓

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

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