UCSF

ZINC40095965

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 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) 4.51 8 -59.81 1 7 -1 99 515.38 7
Hi High (pH 8-9.5) 4.51 8.92 -116.86 0 7 -2 102 514.372 7
Lo Low (pH 4.5-6) 4.51 7.25 -16.85 2 7 0 96 516.388 7

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