UCSF

ZINC40192406

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 33 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) 2.91 12.11 -24.07 1 7 0 76 442.519 9
Lo Low (pH 4.5-6) 2.91 12.5 -43.14 2 7 1 78 443.527 9

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