In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 26 | Yes |
Popular Name: 5-(3-methoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(3-methoxyphenyl)-2-[(4-methyl…
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) | 2.30 | 6.9 | -47.01 | 2 | 6 | 1 | 63 | 371.486 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 6.75 | -51.56 | 2 | 6 | 1 | 63 | 371.486 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 4.51 | -12.26 | 1 | 6 | 0 | 61 | 370.478 | 4 | ↓ |