In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 23 | Yes |
Popular Name: [cyclopropyl-[(2R)-2-hydroxybutyl]amino]methylBLAHone [cyclopropyl-[(2R)-2-hydroxybuty…
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) | 1.91 | 7.26 | -47.59 | 3 | 5 | 1 | 70 | 334.465 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 4.23 | -49.21 | 2 | 5 | 0 | 74 | 333.457 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 5.07 | -11.85 | 2 | 5 | 0 | 69 | 333.457 | 6 | ↓ |