UCSF

ZINC39272179

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 19 Yes

Popular Name: (6S)-N6-(3,4-dichlorophenyl)-6H-purine-2,6-diamine (6S)-N6-(3,4-dichlorophenyl)-6H-…

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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) 2.19 4.83 -13.48 3 6 0 88 295.133 2 ↓
Mid Mid (pH 6-8) 2.19 4.84 -36.24 4 6 1 90 296.141 2 ↓

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

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