UCSF

ZINC41665016

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 30 Yes

Popular Name: 3-(4-chlorophenyl)-4-methyl-9-(4-pyridylmethyl)-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-2-one 3-(4-chlorophenyl)-4-methyl-9-(4…

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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) 4.51 9.79 -13.39 0 5 0 56 418.88 3 ↓
Lo Low (pH 4.5-6) 4.51 12.64 -51.25 1 5 1 57 419.888 3 ↓
Lo Low (pH 4.5-6) 4.51 10.25 -43.98 1 5 1 57 419.888 3 ↓

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

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