UCSF

ZINC39917615

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 34 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) 4.84 12.46 -14.28 0 6 0 49 463.622 12
Mid Mid (pH 6-8) 4.84 14.72 -50.5 1 6 1 50 464.63 12
Mid Mid (pH 6-8) 4.84 12.75 -35.97 1 6 1 50 464.63 12
Lo Low (pH 4.5-6) 4.84 15.02 -104.61 2 6 2 51 465.638 12

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