In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 28 | Yes |
Popular Name: [[(2S)-2-hydroxy-3-morpholino-propyl]-propyl-amino]methylBLAHone [[(2S)-2-hydroxy-3-morpholino-pr…
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) | 1.42 | 4.88 | -56.55 | 3 | 7 | 1 | 83 | 407.56 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 2.12 | -50.54 | 2 | 7 | 0 | 86 | 406.552 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.42 | 7.21 | -128.59 | 4 | 7 | 2 | 84 | 408.568 | 8 | ↓ |