UCSF

ZINC78931541

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2012 17 Yes

Other Names:

MFCD27967419

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) -2.11 -3.97 -52.95 5 6 1 99 238.267 3
Mid Mid (pH 6-8) -2.11 -4.27 -9.42 4 6 0 97 237.259 3

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

No pre-computed analogs available. Try a structural similarity search.