UCSF

ZINC02391024

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 16 No

Popular Name: 5-CHLOROSALICYLIDENE ANILINE 5-CHLOROSALICYLIDENE ANILINE

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CAS Number: 15597-76-9

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) 4.07 4.72 -6.93 1 2 0 33 231.682 2 ↓
Hi High (pH 8-9.5) 4.07 6.7 -43.63 0 2 -1 35 230.674 2 ↓
Hi High (pH 8-9.5) 4.07 5.5 -36.09 0 2 -1 35 230.674 2 ↓
Lo Low (pH 4.5-6) 4.07 6.43 -31.03 2 2 1 34 232.69 2 ↓
Lo Low (pH 4.5-6) 4.07 5.15 -34.17 2 2 1 34 232.69 2 ↓

Activity (Go SEA)

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