UCSF

ZINC39856712

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 31 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) 7.62 15.55 -17.68 1 4 0 51 436.621 10
Hi High (pH 8-9.5) 7.81 13.16 -46.86 0 4 -1 58 435.613 10

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