UCSF

ZINC69766148

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 15 Yes

Popular Name: (1R)-1-pyrazin-2-yl-3-(3-thienyl)propan-1-amine (1R)-1-pyrazin-2-yl-3-(3-thienyl…

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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) -0.13 3.04 -49.3 3 3 1 53 220.321 4 ↓
Mid Mid (pH 6-8) -0.13 2.74 -5.61 2 3 0 52 219.313 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.