UCSF

ZINC13479729

Substance Information

In ZINC since Heavy atoms Benign functionality
June 20th, 2008 30 No

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) 3.50 9.21 -69.82 2 7 1 126 402.478 5
Mid Mid (pH 6-8) 3.50 9.42 -126.61 3 7 2 128 403.486 5

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