UCSF

ZINC40077865

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 32 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) 4.29 8.93 -61.03 0 7 -1 88 438.5 10
Lo Low (pH 4.5-6) 4.29 8.18 -13.55 1 7 0 85 439.508 10

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