UCSF

ZINC04995167

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 14th, 2006 27 No

Popular Name: UNCARINE E UNCARINE E

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CAS Number: 5171-37-9

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) 2.18 7.96 -48.87 2 6 1 69 369.441 2 ↓
Hi High (pH 8-9.5) 2.18 5.82 -10.09 1 6 0 68 368.433 2 ↓

Activity (Go SEA)

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