UCSF

ZINC71572078

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 21 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) 2.65 6.27 -27.13 1 7 0 93 285.259 3
Hi High (pH 8-9.5) 2.65 7.03 -64.85 0 7 -1 95 284.251 3
Lo Low (pH 4.5-6) 2.65 6.69 -42.09 2 7 1 94 286.267 3

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

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