UCSF

ZINC21755899

Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2008 33 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) 4.54 7.97 -21.79 1 9 0 129 487.559 6
Hi High (pH 8-9.5) 4.54 8.04 -47.46 0 9 -1 131 486.551 6

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