UCSF

ZINC40389776

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 19 Yes

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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) 1.73 5.79 -10.49 0 4 0 30 259.353 4
Mid Mid (pH 6-8) 1.73 8.06 -49.67 1 4 1 31 260.361 4
Lo Low (pH 4.5-6) 1.73 8.5 -91.15 2 4 2 33 261.369 4

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