UCSF

ZINC62654447

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2011 18 Yes

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) 2.34 9.69 -31.22 1 3 1 26 251.394 6
Mid Mid (pH 6-8) 2.34 7.67 -7.16 0 3 0 25 250.386 6

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Rings

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