UCSF

ZINC01565128

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 11 No

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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) -1.86 -0.18 -42.81 1 4 -1 69 156.161 3

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0333361A2; EP0367583A2; EP0367583B1; EP0425305B1; EP0582988A3; EP0742800A1; EP0772655B1; EP0808348B1; US4202694; US4256614; US4276370; US4288523; US4355091; US4546159; US4772670; US4852969; US4931582; US4971424; US5045615; US5354642; US5455148; US556119 IBM Patent Data

Activity (Go SEA)

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