UCSF

ZINC41057078

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2010 23 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) 3.90 7.81 -13.27 1 4 0 51 306.365 3
Lo Low (pH 4.5-6) 3.90 8.17 -32.19 2 4 1 52 307.373 3
Lo Low (pH 4.5-6) 4.08 8.2 -30.53 2 4 1 56 307.373 2

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