UCSF

ZINC40091889

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 30 No

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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) 3.84 9.92 -56.53 0 6 -1 83 407.49 9
Lo Low (pH 4.5-6) 3.84 9.17 -13.55 1 6 0 80 408.498 9

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