UCSF

ZINC59817030

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-(2-hydroxyethyl)-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) 2.86 8.26 -10.45 1 7 0 81 390.491 5 ↓
Mid Mid (pH 6-8) 2.86 11.19 -42.86 2 7 1 82 391.499 5 ↓

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

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