UCSF

ZINC65497749

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 26 Yes

Popular Name: 2-[(2R)-1-(cyclopropylmethyl)-4-BLAHyl-piperazin-2-yl]ethanol 2-[(2R)-1-(cyclopropylmethyl)-4-…

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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) 1.68 6.14 -42.96 3 6 1 66 374.534 5 ↓
Hi High (pH 8-9.5) 1.68 3.97 -7.32 2 6 0 65 373.526 5 ↓

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

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