In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: 3-[(1S)-1-aminopropyl]-N-[[(2R)-tetrahydropyran-2-yl]methyl]benzenesulfonamide 3-[(1S)-1-aminopropyl]-N-[[(2R)-…
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) | 0.23 | 2.19 | -58.19 | 4 | 5 | 1 | 83 | 313.443 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.23 | 1.85 | -10.12 | 3 | 5 | 0 | 81 | 312.435 | 6 | ↓ |