UCSF

ZINC00723968

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 23 Yes

Popular Name: ethyl 7-(2,4-dichlorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate ethyl 7-(2,4-dichlorophenyl)-5-m…

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Other Names:

MFCD02971515

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) 3.54 11.84 -10.87 1 6 0 69 353.209 4 ↓
Lo Low (pH 4.5-6) 3.72 12.42 -53.98 2 6 1 74 354.217 4 ↓

Activity (Go SEA)

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