UCSF

ZINC39917618

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 30 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) 4.58 11.25 -12.23 0 5 0 40 407.558 10
Mid Mid (pH 6-8) 4.58 13.51 -49.05 1 5 1 41 408.566 10
Mid Mid (pH 6-8) 4.58 11.54 -34.15 1 5 1 41 408.566 10
Lo Low (pH 4.5-6) 4.58 13.8 -102.69 2 5 2 42 409.574 10

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