In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2011 | 25 | No |
Popular Name: 2-[[(2R)-2-(4-methylpiperazin-1-yl)propyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one 2-[[(2R)-2-(4-methylpiperazin-1-…
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) | 1.17 | 8.43 | -50.26 | 2 | 9 | 1 | 100 | 347.399 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.17 | 6.08 | -20.57 | 1 | 9 | 0 | 99 | 346.391 | 5 | ↓ |