UCSF

ZINC08926989

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 29 No

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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) 3.70 7.95 -15.88 3 8 0 111 431.283 5
Lo Low (pH 4.5-6) 3.70 8.34 -35.46 4 8 1 113 432.291 5

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