UCSF

ZINC04082188

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 18 No

Popular Name: Ilicic acid Ilicic acid

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CAS Number: [4586-68-9]

Download: MOL2 SDF SMILES Flexibase

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) 2.88 5.81 -48.73 1 3 -1 60 251.346 2 ↓
Lo Low (pH 4.5-6) 2.88 4.01 -6.26 2 3 0 58 252.354 2 ↓

Activity (Go SEA)

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