UCSF

ZINC13260041

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 34 Yes

Popular Name: (2S)-3-(1H-indol-3-yl)-2-[[(3R)-1-oxo-3-phenyl-isochroman-6-carbonyl]amino]propanoic (2S)-3-(1H-indol-3-yl)-2-[[(3R)-…

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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) 2.24 12.33 -57.66 2 7 -1 111 453.474 6 ↓

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

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