UCSF

ZINC12010328

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 33 No

Popular Name: N-[5-(2-furyl)-2-(4-oxo-5,6,7,8-tetrahydro-3H-quinazolin-2-yl)pyrazol-3-yl]-4-nitro-benzamide N-[5-(2-furyl)-2-(4-oxo-5,6,7,8-…

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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) 3.11 11.67 -36.77 2 11 0 152 446.423 5 ↓
Mid Mid (pH 6-8) 3.57 11.36 -54.07 1 11 -1 155 445.415 5 ↓
Mid Mid (pH 6-8) 3.11 12.56 -16.54 2 11 0 152 446.423 5 ↓

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

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