기본 정보
- 표준 SMILES
CC1(O)C(O)C(CO)OC1n1ccc(N)nc1=O- InChIKey
PPUDLEUZKVJXSZ-UHFFFAOYSA-N- 분자식
- C10H15N3O5
- 평균 분자량
- 257.24 g/mol
개요
has antiviral activity
이름 및 식별자
- 우선 이름
- 4-amino-1-(3,4-dihydroxy-5-(hydroxymethyl)-3-methyltetrahydrofuran-2-yl)pyrimidin-2(1H)-one
- IUPAC
- 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]pyrimidin-2-one
이름 및 동의어
4-amino-1-(3,4-dihydroxy-5-(hydroxymethyl)-3-methyltetrahydrofuran-2-yl)pyrimidin-2(1H)-oneRefChem:9123004-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]pyrimidin-2-one4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]-1,2-dihydropyrimidin-2-oneCHEMBL192254SCHEMBL1825174PPUDLEUZKVJXSZ-UHFFFAOYSA-NAKOS015957584CCG-297061VU0549341-1EN300-237302F496448
이름 더 보기
BRD-A66966115-001-01-0F9995-03344-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-yl]pyrimidin-2-one4-amino-1-(3,4-dihydroxy-5-hydroxymethyl-3-C-methyl-tetrahydrofuran-2-yl)-1H-pyrimidin-2-one4-Amino-1-(3,4-dihydroxy-5-hydroxymethyl-3-methyl-tetrahydro-furan-2-yl)-1H-pyrimidin-2-one
데이터베이스 식별자
- PubChem CID
- 13871033
- ChEMBL
CHEMBL192254
물성
구조 계산 물성
- XLogP
- -2.4
- 극성 표면적
- 129 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 424
관련 반응
9건
화합물 노트
불러오는 중…