UCSF

ZINC19370624

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 19 Yes

Popular Name: BRD-K93760529-300-01-8 BRD-K93760529-300-01-8

Find On: PubMed — Wikipedia — Google

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) 1.76 2.65 -4.34 1 4 0 34 264.369 7 ↓
Mid Mid (pH 6-8) 1.76 4.03 -38.46 2 4 1 38 265.377 7 ↓
Lo Low (pH 4.5-6) 1.76 4.91 -35.16 2 4 1 35 265.377 7 ↓

Activity (Go SEA)

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