UCSF

ZINC37816847

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 18 Yes

Popular Name: (2S)-2-amino-2-cyclopropyl-1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-1-one (2S)-2-amino-2-cyclopropyl-1-[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) 1.14 3.29 -38.6 3 4 1 51 252.382 4 ↓
Mid Mid (pH 6-8) 1.14 5.51 -93.75 4 4 2 52 253.39 4 ↓

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Rings

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