UCSF

ZINC01680059

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 19 Yes

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Annotations

Vendors

    None

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) -1.31 -8.54 -15.21 6 9 0 150 267.245 2

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0078986A1; EP0090405A1; EP0092709A2; EP0169775A1; EP0192315A1; EP0238672A1; EP0292588A1; EP0292588B1; EP0374096A1; EP0374096B1; EP0414730A1; EP0414730B1; EP0422638A1; EP0422638B1; EP0450102A1; EP0475160B1; EP0628051A1; EP0643069A1; EP0643069B1; EP068267 IBM Patent Data

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