UCSF

ZINC04756095

Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 28 No

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Annotations

None

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) 0.22 -1.25 -53.79 2 8 1 97 384.412 6
Mid Mid (pH 6-8) -0.36 -1.42 -62.89 1 8 1 94 384.412 6
Lo Low (pH 4.5-6) 0.67 -1.52 -122.07 3 8 2 98 385.42 5

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