UCSF

ZINC76945387

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2012 40 No

Popular Name: [(3R,5R,6R,7R,8Z,10R,11S,12Z,14Z)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo- [(3R,5R,6R,7R,8Z,10R,11S,12Z,14Z…

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CAS Number: 30562-34-6

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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) 1.52 2.71 -46.94 3 11 -1 170 559.636 5 ↓
Lo Low (pH 4.5-6) 1.52 1.85 -21.98 4 11 0 167 560.644 5 ↓
Lo Low (pH 4.5-6) -0.88 4.65 -19.66 3 11 0 164 560.644 5 ↓

Vendor Notes

Note Type Comments Provided By
Notes Potent antitumour antibiotic Apollo Scientific Bioactives

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