UCSF

ZINC13696569

Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 27 Yes

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Annotations

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) 3.18 6.3 -16.88 1 6 0 80 386.404 4
Hi High (pH 8-9.5) 3.18 6.38 -59.92 0 6 -1 82 385.396 4

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