UCSF

ZINC95889567

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2014 15 Yes

Other Names:

MFCD00209920

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) 2.94 7.14 -96.67 2 2 2 18 269.186 3
Hi High (pH 8-9.5) 2.94 4.65 -31.38 1 2 1 17 268.178 3

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

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