UCSF

ZINC70101415

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2011 19 Yes

Popular Name: (2R)-1-cyclopropyl-N-[(4-phenyl-1H-triazol-5-yl)methyl]propan-2-amine (2R)-1-cyclopropyl-N-[(4-phenyl-…

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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) 2.73 6.58 -37.54 3 4 1 58 257.361 6 ↓
Mid Mid (pH 6-8) 2.73 6.56 -35.63 2 4 0 56 256.353 6 ↓

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

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