UCSF

ZINC40096570

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 32 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 1.56 2.03 -67.64 2 9 -1 129 505.297 6
Hi High (pH 8-9.5) 1.56 2.94 -123.76 1 9 -2 131 504.289 6
Lo Low (pH 4.5-6) 1.56 1.28 -22.8 3 9 0 126 506.305 6

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