UCSF

ZINC41473081

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 22 No

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Annotations

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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) 2.62 4.74 -28.7 2 4 1 39 316.45 4
Hi High (pH 8-9.5) 2.62 4.35 -8.92 1 4 0 37 315.442 4
Mid Mid (pH 6-8) 2.62 6.99 -91.95 3 4 2 40 317.458 4

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

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