In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: 3-[(1S)-1-aminoethyl]-N-[(3S)-1-cyclopropylpyrrolidin-3-yl]benzenesulfonamide 3-[(1S)-1-aminoethyl]-N-[(3S)-1-…
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) | -0.64 | 3.37 | -107.69 | 5 | 5 | 2 | 78 | 311.451 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.64 | 0.98 | -56.05 | 4 | 5 | 1 | 77 | 310.443 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.64 | 3.23 | -74.39 | 4 | 5 | 1 | 80 | 310.443 | 5 | ↓ |