UCSF

ZINC36704873

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2009 22 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) 5.08 9.64 -11.24 1 3 0 42 369.298 3
Hi High (pH 8-9.5) 5.15 8.01 -42.48 0 3 -1 48 368.29 3

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