In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 28 | Yes |
Popular Name: 1-[3-[[(5S)-9-(m-tolylmethyl)-2,9-diazaspiro[4.5]decan-2-yl]methyl]phenyl]ethanone 1-[3-[[(5S)-9-(m-tolylmethyl)-2,…
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) | 4.07 | 12.43 | -40.69 | 1 | 3 | 1 | 25 | 377.552 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.07 | 12.79 | -39.45 | 1 | 3 | 1 | 25 | 377.552 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.07 | 10.34 | -7.53 | 0 | 3 | 0 | 24 | 376.544 | 5 | ↓ |