UCSF

ZINC63934978

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 29 Yes

Popular Name: (2R)-3-(2H-indol-3-yl)-2-[[3-oxo-3-(4-propoxyphenyl)propyl]amino]propanoic (2R)-3-(2H-indol-3-yl)-2-[[3-oxo…

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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) 2.04 10.59 -87.26 3 6 1 97 395.479 11 ↓
Mid Mid (pH 6-8) 2.04 9.6 -54.63 2 6 0 92 394.471 11 ↓

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

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