In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 27 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-6-[(4-methoxyphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine 2-(4-ethylpiperazin-1-yl)-6-[(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) | 2.76 | 8.56 | -38.74 | 1 | 6 | 1 | 46 | 368.505 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.76 | 6.2 | -8.21 | 0 | 6 | 0 | 45 | 367.497 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 10.96 | -91.68 | 2 | 6 | 2 | 47 | 369.513 | 5 | ↓ |