UCSF

ZINC34872991

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 27 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) 1.57 3.88 -55 5 7 1 99 370.429 8
Hi High (pH 8-9.5) 1.57 2.98 -60.06 3 7 -1 101 368.413 8
Mid Mid (pH 6-8) 1.57 1.76 -17.81 4 7 0 98 369.421 8

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