In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 31 | Yes |
Popular Name: diamino-cyclopentyl-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-oxo-BLAHcarbonitrile diamino-cyclopentyl-[(2S,6S)-2,6…
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) | 2.00 | 7.56 | -15.4 | 4 | 9 | 0 | 134 | 421.505 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 7.99 | -52.82 | 5 | 9 | 1 | 136 | 422.513 | 2 | ↓ |