In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2005 | 25 | No |
Popular Name: 2-methoxy-6-({[4-(1-pyrrolidinylsulfonyl)phenyl]imino}methyl)phenol 2-methoxy-6-({[4-(1-pyrrolidinyl…
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) | 2.73 | 3.33 | -13.3 | 1 | 6 | 0 | 79 | 360.435 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 5.42 | -54.56 | 0 | 6 | -1 | 82 | 359.427 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 4.24 | -46.16 | 0 | 6 | -1 | 82 | 359.427 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 4.96 | -13.14 | 2 | 6 | 0 | 81 | 361.443 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 3.75 | -45.61 | 2 | 6 | 1 | 81 | 361.443 | 5 | ↓ |