UCSF

ZINC12022019

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 30 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 2.31 6.87 -60.09 2 7 1 88 434.513 6
Mid Mid (pH 6-8) 2.31 4.81 -21.22 1 7 0 87 433.505 6

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