UCSF

ZINC00000112

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2005 22 Yes

CAS Number: 64552-17-6

Download: MOL2 SDF SMILES Flexibase

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) 3.37 0 -42.94 3 4 1 63 312.405 9

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Rings

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