In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 20 | Yes |
Popular Name: 2-(6-methyl-2-propyl-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline 2-(6-methyl-2-propyl-pyrimidin-4…
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) | 3.23 | 9.45 | -31.88 | 1 | 3 | 1 | 30 | 268.384 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 9.09 | -5.88 | 0 | 3 | 0 | 29 | 267.376 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.