UCSF

ZINC41651283

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 13 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) 3.15 5.41 -7.75 1 2 0 25 192.287 1
Lo Low (pH 4.5-6) 3.15 5.81 -23.98 2 2 1 26 193.295 1

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