UCSF

ZINC69843333

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 23 Yes

Popular Name: 6-[[(3S)-3-anilinopyrrolidin-1-yl]methyl]-N4,N4-dimethyl-1,3,5-triazine-2,4-diamine 6-[[(3S)-3-anilinopyrrolidin-1-y…

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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) 2.24 9.95 -40.1 4 7 1 84 314.417 5 ↓
Mid Mid (pH 6-8) 2.24 7.55 -8.39 3 7 0 83 313.409 5 ↓

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

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