UCSF

ZINC95869762

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 19 Yes

Other Names:

MFCD01941272

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) -5.30 -5.17 -33.49 6 9 1 134 268.253 2
Mid Mid (pH 6-8) -2.93 -6.07 -17.49 5 9 0 135 267.245 2

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

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