UCSF

ZINC69866825

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 24 No

Popular Name: 4-[[methyl-[(1R)-1-methyl-2-methylsulfonyl-ethyl]amino]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2 4-[[methyl-[(1R)-1-methyl-2-meth…

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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) 1.87 7.38 -17.41 0 5 0 68 349.452 5 ↓
Mid Mid (pH 6-8) 1.87 8.98 -56.79 1 5 1 69 350.46 5 ↓

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

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