UCSF

ZINC00351954

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 23 Yes

Popular Name: BRD-K97742980-001-01-8 BRD-K97742980-001-01-8

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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) 3.26 0.32 -15.5 1 4 0 55 302.333 3 ↓
Lo Low (pH 4.5-6) 3.26 0.43 -45.45 2 4 1 56 303.341 3 ↓

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