UCSF

ZINC16560029

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2008 26 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) 3.13 7.99 -41.49 3 5 1 63 362.4 8
Hi High (pH 8-9.5) 3.13 6.05 -16.08 2 5 0 61 361.392 8
Hi High (pH 8-9.5) 2.94 7.13 -41.77 2 5 0 69 361.392 8

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