UCSF

ZINC19663856

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2008 18 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) 2.29 5.03 -43.3 3 3 1 40 251.394 6
Hi High (pH 8-9.5) 2.29 6.79 -33.76 3 3 1 40 251.394 6
Mid Mid (pH 6-8) 2.29 7.03 -125.7 4 3 2 41 252.402 6

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