In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 25 | Yes |
Popular Name: [cyclohexyl-[(2R)-2-hydroxypropyl]amino]methylBLAHone [cyclohexyl-[(2R)-2-hydroxypropy…
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) | 2.95 | 8.14 | -45.87 | 3 | 5 | 1 | 70 | 362.519 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.40 | 6.16 | -47.91 | 2 | 5 | 0 | 74 | 361.511 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 5.83 | -9.97 | 2 | 5 | 0 | 69 | 361.511 | 5 | ↓ |