In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 21 | No |
Popular Name: 1-[allyl-[[(5S)-3-phenyl-4,5-dihydroisoxazol-5-yl]methyl]amino]-2-methyl-propan-2-ol 1-[allyl-[[(5S)-3-phenyl-4,5-dih…
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) | 2.77 | 7.53 | -35.17 | 2 | 4 | 1 | 46 | 289.399 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 5.93 | -7.57 | 1 | 4 | 0 | 45 | 288.391 | 7 | ↓ |