UCSF

ZINC44264604

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 17 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) 3.03 5.12 -56.2 1 4 -1 65 244.661 1
Hi High (pH 8-9.5) 3.03 4.69 -118.83 0 4 -2 63 243.653 1
Mid Mid (pH 6-8) 3.03 4.4 -9.74 2 4 0 62 245.669 1

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