UCSF

ZINC98240472

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2014 26 Yes

Popular Name: [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]pentanoate valeric acid [(8R,9S,13S,14S,17S)-3-hydroxy-1…

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CAS Number: 979-32-8

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Annotations

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Vendors

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) 5.24 11.31 -47.94 1 3 -1 60 355.498 5 ↓
Lo Low (pH 4.5-6) 5.24 9.34 -8.33 2 3 0 58 356.506 5 ↓

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

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