UCSF

ZINC34929996

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 26 Yes

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) 4.58 9.79 -7.99 0 4 0 33 360.542 10
Mid Mid (pH 6-8) 4.58 12.1 -55.09 1 4 1 34 361.55 10

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