UCSF

ZINC33917710

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 28 No

CAS Number: 3564-14-5

Download: MOL2 SDF SMILES Flexibase

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) 1.65 4.27 -50.57 2 7 -1 119 393.4 3

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