UCSF

ZINC02019996

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 26 Yes

Popular Name: alol alol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 85320-68-9 , 93633-92-2 , [70958-86-0] , [93633-92-2]

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) 0.93 1.27 -53.76 5 7 1 115 381.474 9 ↓
Hi High (pH 8-9.5) 0.93 -0.19 -17.06 4 7 0 111 380.466 9 ↓

Activity (Go SEA)

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