UCSF

ZINC00703575

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 33 Yes

Popular Name: 5-methyl-7-{4-[(phenylmethyl)oxy]phenyl}-N-pyridin-2-yl-4,7-dihydrotetraazolo[1,5-a]pyrimidine-6-carboxamide 5-methyl-7-{4-[(phenylmethyl)oxy…

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Other Names:

MFCD02130118

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) 3.44 12.16 -15.92 2 9 0 107 439.479 6 ↓
Lo Low (pH 4.5-6) 3.44 0.54 -39.25 3 9 1 108 440.487 6 ↓
Lo Low (pH 4.5-6) 3.61 11.86 -36.44 3 9 1 112 440.487 6 ↓

Activity (Go SEA)

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