UCSF

ZINC71572079

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 22 No

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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) 3.03 7.17 -27.07 1 7 0 93 299.286 4
Hi High (pH 8-9.5) 3.03 7.94 -64.64 0 7 -1 95 298.278 4
Lo Low (pH 4.5-6) 3.03 7.6 -42.19 2 7 1 94 300.294 4

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

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