UCSF

ZINC32607987

Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2009 34 Yes

Download: MOL2 SDF SMILES Flexibase

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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) 2.26 7.92 -40.3 4 8 0 127 470.407 6
Hi High (pH 8-9.5) 3.56 7.53 -51.75 3 8 -1 130 469.399 6
Mid Mid (pH 6-8) 2.26 8.33 -60.51 5 8 1 128 471.415 6

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