UCSF

ZINC20127001

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 18 Yes

Popular Name: (4R)-N-(2-pyrrolidin-1-ylethyl)chroman-4-amine (4R)-N-(2-pyrrolidin-1-ylethyl)c…

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Annotations

None

Vendors

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) 1.35 4.88 -42.79 2 3 1 29 247.362 4 ↓
Hi High (pH 8-9.5) 1.35 4.13 -3.19 1 3 0 24 246.354 4 ↓
Mid Mid (pH 6-8) 1.35 7.44 -123.13 3 3 2 30 248.37 4 ↓
Mid Mid (pH 6-8) 1.35 6.33 -38.38 2 3 1 26 247.362 4 ↓

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Rings

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

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