UCSF

ZINC60118121

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2011 31 No

Popular Name: (3R,8S,9R,10S,13S,14S,17S)-3-(4-dimethylaminophenyl)-13-methyl-17-prop-1-ynyl-2,3,6,7,8,9,10,11,12,1 (3R,8S,9R,10S,13S,14S,17S)-3-(4-…

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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) 7.04 13.71 -5.42 1 2 0 23 417.637 2 ↓
Lo Low (pH 4.5-6) 7.04 14.5 -18.43 2 2 0 25 418.645 2 ↓

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

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