UCSF

ZINC85914490

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 25th, 2013 52 No

Popular Name: (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2R,3S,4R,6S)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydro (3R,4S,5S,6R,7R,9R,11R,12R,13S,1…

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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) 2.90 6.01 -45.41 5 14 1 184 748.972 8 ↓
Hi High (pH 8-9.5) 2.90 3.6 -17.6 4 14 0 183 747.964 8 ↓

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

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