UCSF

ZINC60023515

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 40 No

Popular Name: (6S,7S)-3-(acetoxymethyl)-7-[[(2R)-3-indan-5-yloxy-3-oxo-2-(3-thienyl)propanoyl]amino]-7-methoxy-8-o (6S,7S)-3-(acetoxymethyl)-7-[[(2…

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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) 1.47 12.8 -86.03 1 11 -1 151 585.636 11 ↓
Hi High (pH 8-9.5) 1.50 12.14 -142.78 1 11 -2 157 584.628 11 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4203982 IBM Patent Data

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

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