UCSF

ZINC37798491

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 19 Yes

Popular Name: (2S)-2-amino-2-cyclopropyl-1-[(1S)-1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propan-1-o (2S)-2-amino-2-cyclopropyl-1-[(1…

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) 1.64 5.44 -44.23 3 4 1 53 262.377 2 ↓
Hi High (pH 8-9.5) 1.64 5.2 -8.8 2 4 0 51 261.369 2 ↓

Activity (Go SEA)

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