UCSF

ZINC38138137

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2009 32 Yes

Popular Name: (2S)-2-[[2-chloro-4-[3-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)propylamino]benzoyl]amino]pentanedioic (2S)-2-[[2-chloro-4-[3-(2,6-diam…

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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) -1.44 5.17 -138.03 7 12 -2 219 464.866 11 ↓
Lo Low (pH 4.5-6) -1.44 3.2 -82.97 8 12 -1 216 465.874 11 ↓

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

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