UCSF

ZINC02560258

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 34 Yes

CAS Number: 139298-40-1

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Annotations

None

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) 5.16 11.33 -47.88 2 6 1 71 502.056 11
Hi High (pH 8-9.5) 5.16 11.6 -11.91 1 6 0 70 501.048 11

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

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