UCSF

ZINC40181510

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 34 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) 3.47 11.67 -19.28 1 7 0 78 458.562 12
Mid Mid (pH 6-8) 3.47 11.97 -43.32 2 7 1 80 459.57 12

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