UCSF

ZINC59816947

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 29 Yes

Popular Name: 5-[(2S)-2-(dimethylamino)pyrrolidin-1-yl]-2-(methoxymethyl)-7-methyl-6-phenyl-[1,2,4]triazolo[1,5-a] 5-[(2S)-2-(dimethylamino)pyrroli…

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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) 3.27 9.96 -11.42 0 7 0 70 390.491 5 ↓
Mid Mid (pH 6-8) 3.27 12.88 -41.35 1 7 1 71 391.499 5 ↓

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

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