UCSF

ZINC49524577

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 20 No

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Annotations

Vendors

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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) 1.35 1 -16.16 3 7 0 111 272.264 3
Hi High (pH 8-9.5) 1.53 -1.66 -46.81 2 7 -1 117 271.256 3

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

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