In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 21 | Yes |
Popular Name: 1-[2-(aminomethyl)phenyl]-N-[(3R)-1-cyclopropylpyrrolidin-3-yl]methanesulfonamide 1-[2-(aminomethyl)phenyl]-N-[(3R…
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) | 0.72 | 3.41 | -115.08 | 5 | 5 | 2 | 78 | 311.451 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 1.02 | -59.26 | 4 | 5 | 1 | 77 | 310.443 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 3.96 | -43.39 | 4 | 5 | 1 | 77 | 310.443 | 6 | ↓ |