UCSF

ZINC72190319

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2012 31 Yes

CAS Number: 59619-81-7

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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) 2.81 7.1 -51.29 2 7 -1 108 431.505 11
Lo Low (pH 4.5-6) 2.81 5.12 -14.96 3 7 0 105 432.513 11

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