UCSF

ZINC60120470

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2011 23 No

Popular Name: 4-[[3-(2-hydroxyethyl)-4-imino-pyrimido[5,4-d]pyrimidin-8-yl]amino]benzonitrile 4-[[3-(2-hydroxyethyl)-4-imino-p…

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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) -2.70 5.56 -38.39 4 8 1 125 308.325 4 ↓
Hi High (pH 8-9.5) -0.42 5.47 -14.2 3 8 0 124 307.317 4 ↓

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

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