UCSF

ZINC36864743

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 19 Yes

Popular Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-[[(2S)-tetrahydrofuran-2-yl]methoxy]propan-1-amine N-[(3,5-dimethyl-1H-pyrazol-4-yl…

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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) 0.88 4.01 -46.09 3 5 1 64 268.381 8 ↓
Hi High (pH 8-9.5) 0.88 2.64 -9.52 2 5 0 59 267.373 8 ↓

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

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