UCSF

ZINC69492530

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 24 No

Popular Name: 3-[3-methyl-4-(tetrazol-1-yl)phenyl]-2-thioxo-1H-quinazolin-4-one 3-[3-methyl-4-(tetrazol-1-yl)phe…

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Download: MOL2 SDF SMILES Flexibase

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) 1.77 9.72 -17.9 1 7 0 81 336.38 2 ↓
Mid Mid (pH 6-8) 2.50 9.43 -43.89 0 7 -1 79 335.372 2 ↓

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

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