UCSF

ZINC38138134

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2009 33 Yes

Popular Name: (2S)-2-[[4-[3-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)propylamino]-3-methoxy-benzoyl]amino]pentanedioic (2S)-2-[[4-[3-(2,6-diamino-4-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) -2.06 4.11 -137.25 7 13 -2 228 460.447 12 ↓
Lo Low (pH 4.5-6) -2.06 2.17 -79.99 8 13 -1 226 461.455 12 ↓

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

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