UCSF

ZINC39881598

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 31 No

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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) 2.16 10.96 -77.41 3 7 2 63 419.529 4
Hi High (pH 8-9.5) 2.16 8.46 -16.73 1 7 0 61 417.513 4
Mid Mid (pH 6-8) 2.16 8.6 -33.92 2 7 1 62 418.521 4
Mid Mid (pH 6-8) 2.16 10.82 -47.65 2 7 1 62 418.521 4

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