UCSF

ZINC44118537

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2010 20 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) 4.34 7.45 -34.95 2 3 1 34 284.464 1
Mid Mid (pH 6-8) 4.34 4.99 -2.4 1 3 0 33 283.456 1

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