UCSF

ZINC15894719

Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2008 34 No

CAS Number: 58-05-9

Other Names:

MFCD00867488

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Annotations

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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) -3.99 3.16 -131.28 5 14 -2 222 471.43 9
Hi High (pH 8-9.5) -3.99 3.95 -146.65 5 14 -2 221 471.43 9
Mid Mid (pH 6-8) -3.99 3.6 -148.63 6 14 -1 223 472.438 9
Lo Low (pH 4.5-6) -3.99 1.58 -106.03 7 14 0 220 473.446 9

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