In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 32 | Yes |
Popular Name: 4-[2-(4-ethylpiperazin-1-yl)acetyl]-9-pentoxy-2,3-dihydro-1H-chromeno[3,4-b]pyridin-5-one 4-[2-(4-ethylpiperazin-1-yl)acet…
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) | 4.13 | 12.55 | -46.15 | 1 | 7 | 1 | 67 | 442.58 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.13 | 10.38 | -19.32 | 0 | 7 | 0 | 66 | 441.572 | 8 | ↓ |