In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2004 | 13 | No |
(3S)-3-isopropenyl-6-oxoheptanoate
(3S)-3-Isopropenyl-6-oxoheptanoate; (3S)-3-Isopropenyl-6-oxoheptanoic acid; C11419
(3S)-3-Isopropenyl-6-oxoheptanoate; (3S)-4-methyl-3-(3-oxobutyl)pent-4-enoate
(3S)-3-isopropenyl-6-oxoheptanoate; CPD-10063
(3S)-3-isopropenyl-6-oxoheptanoic acid
None
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) | 1.48 | 2.43 | -47.95 | 0 | 3 | -1 | 57 | 183.227 | 6 | ↓ |