In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 19 | Yes |
Popular Name: 2-[[[(3S)-1-cyclopropylpyrrolidin-3-yl]amino]methyl]-6-methoxy-phenol 2-[[[(3S)-1-cyclopropylpyrrolidi…
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) | 1.55 | 3.12 | -42.36 | 3 | 4 | 1 | 49 | 263.361 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 3.98 | -34.32 | 2 | 4 | 0 | 52 | 262.353 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 1.92 | -5.19 | 2 | 4 | 0 | 45 | 262.353 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.56 | 4.32 | -34.58 | 3 | 4 | 1 | 46 | 263.361 | 5 | ↓ |