UCSF

ZINC53357230

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 28 No

Popular Name: 2-[2-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-2-oxo-ethyl]-2,4-diazaspiro[4.4]nonane-1,3-dione 2-[2-[(2S)-2-(1H-benzimidazol-2-…

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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) 1.58 6.13 -22.57 2 8 0 98 381.436 3 ↓
Lo Low (pH 4.5-6) 1.58 6.63 -32.53 3 8 1 100 382.444 3 ↓

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

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