UCSF

ZINC32501373

Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2009 31 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) 2.78 7.16 -71.23 1 7 1 87 442.513 3
Mid Mid (pH 6-8) 2.78 4.3 -20.83 0 7 0 86 441.505 3

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