UCSF

ZINC01111655

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 29 Yes

Popular Name: (7R)-7-(3-ethoxy-4-hydroxy-phenyl)-5-methyl-N-phenyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxa (7R)-7-(3-ethoxy-4-hydroxy-pheny…

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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) 2.40 7.21 -16.52 3 9 0 114 392.419 5 ↓
Hi High (pH 8-9.5) 2.21 6.45 -35.94 2 9 -1 121 391.411 5 ↓
Lo Low (pH 4.5-6) 2.58 7.33 -36.58 4 9 1 119 393.427 5 ↓

Activity (Go SEA)

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