UCSF

ZINC39869611

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 23 No

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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) 4.25 3.4 -15.29 3 5 0 82 326.377 3
Hi High (pH 8-9.5) 4.25 3.52 -104.81 1 5 -2 87 324.361 3
Mid Mid (pH 6-8) 4.25 2.74 -47.74 2 5 -1 85 325.369 3

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