UCSF

ZINC00949701

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 31 Yes

Popular Name: (7R)-5-methyl-2-phenyl-N,7-bis(3-pyridyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide (7R)-5-methyl-2-phenyl-N,7-bis(3…

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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) 2.63 10.84 -13.87 2 8 0 98 409.453 4 ↓
Hi High (pH 8-9.5) 2.81 10.71 -47.56 1 8 -1 99 408.445 4 ↓
Mid Mid (pH 6-8) 2.81 11.21 -36.74 3 8 1 102 410.461 4 ↓

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

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