UCSF

ZINC38810810

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2010 33 No

CAS Number: [68016-05-7]

Other Names:

MFCD00071988

Download: MOL2 SDF SMILES Flexibase

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) 5.19 6.15 -27.02 4 8 0 126 440.459 6
Hi High (pH 8-9.5) 5.19 7.16 -80.1 3 8 -1 129 439.451 6

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