In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 17 | Yes |
Popular Name: 2-[[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]methyl]phenol 2-[[[(3R)-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) | 1.95 | 3.14 | -40.72 | 3 | 3 | 1 | 40 | 233.335 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 3.84 | -31.58 | 2 | 3 | 0 | 43 | 232.327 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.95 | 5.49 | -111.48 | 4 | 3 | 2 | 41 | 234.343 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.95 | 4.25 | -33.76 | 3 | 3 | 1 | 37 | 233.335 | 4 | ↓ |