UCSF

ZINC39272088

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 20 Yes

Popular Name: (6S)-N6-(4-isopropylphenyl)-6H-purine-2,6-diamine (6S)-N6-(4-isopropylphenyl)-6H-p…

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Vendors

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) 2.42 5.33 -7.04 3 6 0 89 268.324 3 ↓
Lo Low (pH 4.5-6) 2.42 6.37 -33.51 4 6 1 90 269.332 3 ↓

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

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