BitterDB ID=197

Dyphylline

BitterDB id=197

References for the compound bitterness

	Resource	Comment
[1]	Merck Index Monograph Number: 3479	extremely bitter crystals

Known bitter receptors targets:

There is no available data on associated receptors

Sensory data about the compound bitterness:

There is no sensory data available

Properties:

Mol. Weight: 254.2500 [g/mol]	AlogP(octanol-water): -2.21310
# Hydrogen Bond Donor: 2	# Hydrogen Bond Acceptor: 8
# Aromatic Rings: 2	# Rings: 2
# Rotatable Bonds: 3

Identifiers:

CAS Registry Number: 479-18-5

Formula: C10H14N4O4

IUPAC Systematic Name:

SMILES:

Canonical SMILES:

InChI Key: KSCFJBIXMNOVSH-UHFFFAOYSA-N

Links:

[1]	PubChem	3182
[2]	ZINC	ZINC000000057146	ZINC000000057147
[3]	DrugBank	DB00651
[4]	Guide to PHARMACOLOGY	7070