UCSF

ZINC70114244

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2011 18 Yes

Popular Name: N-[(1R,2R,4S)-2,4-dimethylcyclohexyl]thieno[3,2-d]pyrimidin-4-amine N-[(1R,2R,4S)-2,4-dimethylcycloh…

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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) 3.43 8.29 -6.48 1 3 0 38 261.394 2 ↓
Lo Low (pH 4.5-6) 3.43 8.75 -27.38 2 3 1 39 262.402 2 ↓

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

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