UCSF

ZINC36119195

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 31 Yes

Popular Name: N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]-4-[[(2-morpholino-3,4-dioxo-cyclobuten-1-yl)amino]methyl]cyclo N-[(1R,2R,3R)-2,3-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) -0.83 6.29 -35.82 3 7 1 91 432.585 5 ↓
Hi High (pH 8-9.5) -0.19 4.53 -19.66 2 7 0 97 431.577 4 ↓

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

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