UCSF

ZINC36704589

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2009 23 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) 4.21 9.85 -17.81 1 4 0 51 344.461 5
Hi High (pH 8-9.5) 4.40 7.26 -47.25 0 4 -1 58 343.453 5

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